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N-Propionylprocainamide

HCID 197959
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Basic information

CAS
101427-17-2
Standard SMILES
CCC(=O)Nc1ccc(C(=O)NCCN(CC)CC)cc1
InChIKey
CTHPVGZIOICAFO-UHFFFAOYSA-N
Molecular formula
C16H25N3O2
Average molar mass
291.39 g/mol
Monoisotopic mass
291.19467705

Names & identifiers

Preferred name
N-Propionylprocainamide
IUPAC
N-[2-(diethylamino)ethyl]-4-(propanoylamino)benzamide

Names & synonyms

N-PropionylprocainamideDTXSID70276755RefChem:927324DTXCID9020120667635-46-5NPPA101427-17-2N-[2-(diethylamino)ethyl]-4-(propanoylamino)benzamideN-[2-(Diethylamino)ethyl]-4-[(1-oxopropyl)amino]benzamideBenzamide, N-[2-(diethylamino)ethyl]-4-[(1-oxopropyl)amino]-N-[2-(diethylamino)ethyl]-4-propanamidobenzamidePropionylprocainamide
Show more names
Procainamide-n-propionylCF3AF63XYNN-(2-diethylaminoethyl)-4-(propanoylamino)benzamideSCHEMBL1230694CTHPVGZIOICAFO-UHFFFAOYSA-NMSK174893AKOS016614881NS00093646

Database identifiers

CAS
101427-17-2、67635-46-5
PubChem CID
197959
DTXSID
DTXSID70276755
UNII
CF3AF63XYN
EC Number
621-669-0
Nikkaji
J236.667C

Properties

Computed structural properties

XLogP
1.2
Topological polar surface area
61.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
21
Formal charge
0
Complexity
321

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Related reactions

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Compound notes

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