1-(3-Aminopropyl)-2-pyrrolidinone

HCID 82111
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Basic information

CAS
7663-77-6
Standard SMILES
NCCCN1CCCC1=O
InChIKey
HJORCZCMNWLHMB-UHFFFAOYSA-N
Molecular formula
C7H14N2O
Average molar mass
142.2 g/mol
Monoisotopic mass
142.11061307

Overview

product of spermidine catabolism in mice

Names & identifiers

Preferred name
1-(3-Aminopropyl)-2-pyrrolidinone
IUPAC
1-(3-aminopropyl)pyrrolidin-2-one
English name
1-(3-Aminopropyl)-2-pyrrolidinone
Molecular formula
C7H14N2O
Molecular weight
142.2

Names & synonyms

7663-77-61-(3-Aminopropyl)-2-pyrrolidinoneN-(3-Aminopropyl)pyrrolidin-2-oneDTXSID80227455RefChem:826197DTXCID80149946231-632-71-(3-aminopropyl)pyrrolidin-2-one2-Pyrrolidinone, 1-(3-aminopropyl)-N-(3-Aminopropyl)-2-pyrrolidinoneN-(3'-AMINOPROPYL)-2-PYRROLIDINONE1-(3-Aminopropyl)-2-pyrrolidone
Show more names
RARECHEM AL BW 2176Isoputreanine γ-lactamN-(3-pyrrolidinyl)propanamide1-(3-aminopropyl)-2-pyrrolidinon1-(3-Aminopropyl)pyrolidin-2-oneN-(3-AMinopropyl)-γ-butyrolactaMN-(3-propylamine) -2-pyrrolidone
MFCD000032011-(3-Aminoprop-1-yl)pyrrolidin-2-onen-(3'-aminopropyl)-2-pyrrolidoneEINECS 231-632-7NSC 108683BRN 01149601-(3-aminopropyl)pyrrolidin-2-on4-21-00-03163 (Beilstein Handbook Reference)

Database identifiers

CAS
7663-77-6
PubChem CID
82111
DTXSID
DTXSID80227455
EC Number
231-632-7
Nikkaji
J51.465I

Properties

Computed structural properties

XLogP
-0.8
Topological polar surface area
46.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
3
Heavy atoms
10

Physicochemical properties

Boiling point
120 · 120-123 °C1 mm Hg(lit.)
Density
1.014 g/mL · 1.014 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.5(lit.)
Flash point
230 °F · >230 °F
storage temp.
2 · Keep in dark place,Sealed in dry,2-8°C
solubility
Chloroform (Slightly), Methanol (Slightly)

Safety & regulation

GHS classification

GHS Classification · 4 items

Danger

H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 41 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesSkin Corr. 1B (100%)

Safety data

F
9-34
PPE
Faceshields, Gloves, Goggles, type ABEK (EN14387) respirator filter
wgk
3
rtecs
UY5739500
ridadr
UN 3267 8/PG 2
hs_code
29337900

Chemistry & industry

Applications · 3 items

Uses1-(3-AMinopropyl)-2-pyrrolidinone can be used as a useful synthetic intermediate.

UsesN-(3-Aminopropyl)-2-pyrrolidinone was used in the simultaneous determination of total polyamines and three of their nonα amino acid metabolites in urine by capillary gas-chromatographic method with nitrogen-phosphorus detection.

General DescriptionN-(3-Aminopropyl)-2-pyrrolidinone (PYR) conjugates (VPA-PYR) of valproic acid (VA) have been investigated for their anticonvulsant activity in mice. It is the γ-lactam form of isoputreanine.

Upstream & downstream products

Suppliers69 total

上海康恩博医药科技有限公司17510465506 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]

Related reactions

107 records
New reaction record

Compound notes

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