(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide

C13H17N3O3 — CID 172675207

IUPAC(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide
SMILESNC(=O)[C@H]1CCCN(C(=O)Cc2ccc[nH]c2=O)C1
InChIInChI=1S/C13H17N3O3/c14-12(18)10-4-2-6-16(8-10)11(17)7-9-3-1-5-15-13(9)19/h1,3,5,10H,2,4,6-8H2,(H2,14,18)(H,15,19)/t10-/m0/s1
InChIKeyYJUWSGAKKBDWFC-JTQLQIEISA-N
MW263.30 g/mol
LogP-0.36
Rot. Bonds3

About (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide

(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide (PubChem CID 172675207) has the molecular formula C13H17N3O3 and a molecular weight of 263.30 g/mol. Its IUPAC name is (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide
PubChem CID172675207
Molecular FormulaC13H17N3O3
Molecular Weight263.30 g/mol
Exact Mass263.13
IUPAC Name(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide
SMILESNC(=O)[C@H]1CCCN(C(=O)Cc2ccc[nH]c2=O)C1
InChIInChI=1S/C13H17N3O3/c14-12(18)10-4-2-6-16(8-10)11(17)7-9-3-1-5-15-13(9)19/h1,3,5,10H,2,4,6-8H2,(H2,14,18)(H,15,19)/t10-/m0/s1
InChIKeyYJUWSGAKKBDWFC-JTQLQIEISA-N
XLogP-0.36
TPSA96.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-Ethyl-5-{[4-(piperidine-3-carbonyl)piperazin-1-YL]methyl}-1,2-dihydropyridin-2-one
CID 53191700
5-[[(3S)-1-[3-(2-oxopiperidin-1-yl)propanoyl]pyrrolidin-3-yl]methyl]-1H-pyridin-2-one
CID 97154346
5-(trifluoromethyl)piperidin-2-one;5-(trifluoromethyl)-1H-pyridin-2-one
CID 161729260
3-[4-fluoro-3-(6-oxo-1H-pyridin-3-yl)piperidin-1-yl]propanamide
CID 175468536
1-(3-Fluoropiperidin-4-yl)-3-propan-2-ylpyridin-2-one
CID 177200058
1-[(3S,4R)-3-fluoropiperidin-4-yl]-3-propan-2-ylpyridin-2-one
CID 177200099
3-(1,2-dihydro-1-methyl-2-oxo-3-pyridinyl)-2,6-Piperidinedione
CID 132117793
(3S)-1-[2-(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide
CID 172675174
(3S)-1-[2-(3-bromo-2-oxo-1H-pyridin-4-yl)acetyl]piperidine-3-carboxamide
CID 172675200
1-Oxotetrahydroisoquinoline-4-carboxamide
CID 135563821
1-(2,2-difluoroethyl)-N-[(6-oxo-1H-pyridin-3-yl)methyl]piperidine-4-carboxamide
CID 132376878
N-[(6-oxo-1H-pyridin-3-yl)methyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 146122958

Frequently Asked Questions

What is the IUPAC name of (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide?
The IUPAC name of (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide (CID 172675207) is (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide.
What is the SMILES notation for (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide?
The canonical SMILES for (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide is NC(=O)[C@H]1CCCN(C(=O)Cc2ccc[nH]c2=O)C1.
What is the InChIKey of (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide?
The InChIKey is YJUWSGAKKBDWFC-JTQLQIEISA-N. The full InChI is InChI=1S/C13H17N3O3/c14-12(18)10-4-2-6-16(8-10)11(17)7-9-3-1-5-15-13(9)19/h1,3,5,10H,2,4,6-8H2,(H2,14,18)(H,15,19)/t10-/m0/s1.
What are the key properties of (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide?
(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide has a molecular weight of 263.30 g/mol, XLogP of -0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide is sourced from PubChem (CID 172675207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).