(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide

C12H15N3O3 — CID 28826297

IUPAC(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(C(=O)c2ccc(=O)[nH]c2)C1
InChIInChI=1S/C12H15N3O3/c13-11(17)9-2-1-5-15(7-9)12(18)8-3-4-10(16)14-6-8/h3-4,6,9H,1-2,5,7H2,(H2,13,17)(H,14,16)/t9-/m1/s1
InChIKeySPMSBMRBOBPCOC-SECBINFHSA-N
MW249.27 g/mol
LogP-0.29
Rot. Bonds2

About (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide

(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide (PubChem CID 28826297) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
PubChem CID28826297
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC Name(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
SMILESNC(=O)[C@@H]1CCCN(C(=O)c2ccc(=O)[nH]c2)C1
InChIInChI=1S/C12H15N3O3/c13-11(17)9-2-1-5-15(7-9)12(18)8-3-4-10(16)14-6-8/h3-4,6,9H,1-2,5,7H2,(H2,13,17)(H,14,16)/t9-/m1/s1
InChIKeySPMSBMRBOBPCOC-SECBINFHSA-N
XLogP-0.29
TPSA96.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-aminoethyl)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 63252564
(3S)-1-(4-fluorobenzoyl)piperidine-3-carboxamide
CID 68704612
5-[(3R,4R)-4-(azepan-1-yl)-3-hydroxypiperidine-1-carbonyl]-1H-pyridin-2-one
CID 56866375
5-[3-(2-hydroxyethyl)piperidine-1-carbonyl]-1H-pyridin-2-one
CID 55064660
5-(3-pyrrolidin-3-ylpiperidine-1-carbonyl)-1H-pyridin-2-one
CID 167899187
1-(6-oxo-1H-pyridine-3-carbonyl)pyrrolidine-2-carboxamide
CID 43120481
1-(3,5-dihydroxybenzoyl)piperidine-3-carboxamide
CID 103891600
1-(4-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide
CID 103336874
1-(4-amino-3-fluorobenzoyl)piperidine-3-carboxamide
CID 62678681
5-[3-(1-aminoethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 112630666
1-(4-phenoxybenzoyl)piperidine-3-carboxamide
CID 18159127
5-(2-ethyl-1,4-oxazepane-4-carbonyl)-1H-pyridin-2-one
CID 114217645

Frequently Asked Questions

What is the IUPAC name of (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide (CID 28826297) is (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide is NC(=O)[C@@H]1CCCN(C(=O)c2ccc(=O)[nH]c2)C1.
What is the InChIKey of (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is SPMSBMRBOBPCOC-SECBINFHSA-N. The full InChI is InChI=1S/C12H15N3O3/c13-11(17)9-2-1-5-15(7-9)12(18)8-3-4-10(16)14-6-8/h3-4,6,9H,1-2,5,7H2,(H2,13,17)(H,14,16)/t9-/m1/s1.
What are the key properties of (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide?
(3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 249.27 g/mol, XLogP of -0.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-(6-oxo-1H-pyridine-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 28826297), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).