(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide

C9H14N2O2 — CID 131089266

IUPAC(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide
SMILESC=CCNC(=O)[C@H]1CCCC(=O)N1
InChIInChI=1S/C9H14N2O2/c1-2-6-10-9(13)7-4-3-5-8(12)11-7/h2,7H,1,3-6H2,(H,10,13)(H,11,12)/t7-/m1/s1
InChIKeyPHIUEOBYFPFCPE-SSDOTTSWSA-N
MW182.22 g/mol
LogP-0.04
Rot. Bonds3

About (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide

(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide (PubChem CID 131089266) has the molecular formula C9H14N2O2 and a molecular weight of 182.22 g/mol. Its IUPAC name is (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide.

Molecular Properties

Compound Name(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide
PubChem CID131089266
Molecular FormulaC9H14N2O2
Molecular Weight182.22 g/mol
Exact Mass182.11
IUPAC Name(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide
SMILESC=CCNC(=O)[C@H]1CCCC(=O)N1
InChIInChI=1S/C9H14N2O2/c1-2-6-10-9(13)7-4-3-5-8(12)11-7/h2,7H,1,3-6H2,(H,10,13)(H,11,12)/t7-/m1/s1
InChIKeyPHIUEOBYFPFCPE-SSDOTTSWSA-N
XLogP-0.04
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 5-0.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide?
The IUPAC name of (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide (CID 131089266) is (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide.
What is the SMILES notation for (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide?
The canonical SMILES for (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide is C=CCNC(=O)[C@H]1CCCC(=O)N1.
What is the InChIKey of (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide?
The InChIKey is PHIUEOBYFPFCPE-SSDOTTSWSA-N. The full InChI is InChI=1S/C9H14N2O2/c1-2-6-10-9(13)7-4-3-5-8(12)11-7/h2,7H,1,3-6H2,(H,10,13)(H,11,12)/t7-/m1/s1.
What are the key properties of (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide?
(2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide has a molecular weight of 182.22 g/mol, XLogP of -0.04, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-6-oxo-N-prop-2-enylpiperidine-2-carboxamide is sourced from PubChem (CID 131089266), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).