3-(Piperidin-1-yl)propanamide

HCID 566784

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Basic information

CAS: 4269-30-1
Standard SMILES: NC(=O)CCN1CCCCC1
InChIKey: ZMDWVDOBEGZQJC-UHFFFAOYSA-N
Molecular formula: C8H16N2O
Average molar mass: 156.23 g/mol
Monoisotopic mass: 156.12626313

Names & identifiers

Preferred name: 3-(Piperidin-1-yl)propanamide
IUPAC: 3-piperidin-1-ylpropanamide
English name: 3-(PIPERIDIN-1-YL)PROPANAMIDE
Molecular formula: C8H16N2O
Molecular weight: 156.23

Names & synonyms

3-(Piperidin-1-yl)propanamide4269-30-1DTXSID30340724RefChem:275860DTXCID502918051-piperidinepropanamideBAS 002859301-piperidine-propanamideOprea1_104536Oprea1_617410MLS000717788SCHEMBL1010008

Show more names

SCHEMBL3527441SCHEMBL4322835CHEMBL13442983-(1-Piperidinyl)propanamide #Propionamide, 3-(1-piperidyl)-HMS2691I12AKOS000601530SB42035

Database identifiers

CAS: 4269-30-1
PubChem CID: 566784
DTXSID: DTXSID30340724
ChEMBL: CHEMBL1344298
Nikkaji: J1.992.106I

Properties

Computed structural properties

XLogP: 0
Topological polar surface area: 46.3 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 2
Rotatable bonds: 3
Heavy atoms: 11
Formal charge: 0
Complexity: 130

Experimental & physicochemical properties

Solubility>23.4 [ug/mL] (The mean of the results at pH 7.4)

Physicochemical properties

Melting point: 80 · 80-81°
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302-H315-H319-H335
Precautionary statements: 261 · P261-P301+P312-P302+P352-P304+P340-P305+P351+P338