4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide

C12H17N3O2 — CID 142705525

IUPAC4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide
SMILESCn1ccc(C2CCNCC2C(N)=O)cc1=O
InChIInChI=1S/C12H17N3O2/c1-15-5-3-8(6-11(15)16)9-2-4-14-7-10(9)12(13)17/h3,5-6,9-10,14H,2,4,7H2,1H3,(H2,13,17)
InChIKeyAODYMGIZMKXMKZ-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.44
Rot. Bonds2

About 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide

4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide (PubChem CID 142705525) has the molecular formula C12H17N3O2 and a molecular weight of 235.29 g/mol. Its IUPAC name is 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide
PubChem CID142705525
Molecular FormulaC12H17N3O2
Molecular Weight235.29 g/mol
Exact Mass235.13
IUPAC Name4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide
SMILESCn1ccc(C2CCNCC2C(N)=O)cc1=O
InChIInChI=1S/C12H17N3O2/c1-15-5-3-8(6-11(15)16)9-2-4-14-7-10(9)12(13)17/h3,5-6,9-10,14H,2,4,7H2,1H3,(H2,13,17)
InChIKeyAODYMGIZMKXMKZ-UHFFFAOYSA-N
XLogP-0.44
TPSA77.12 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-[[(3S)-1-[3-(2-oxopiperidin-1-yl)propanoyl]pyrrolidin-3-yl]methyl]-1H-pyridin-2-one
CID 97154346
4-[1-[[(3S)-1-ethylpiperidin-3-yl]methyl]piperidin-4-yl]-1H-pyridin-2-one
CID 171359635
3-[4-fluoro-3-(6-oxo-1H-pyridin-3-yl)piperidin-1-yl]propanamide
CID 175468536
(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
(3S)-1-[2-(2-oxo-1H-pyridin-3-yl)acetyl]piperidine-3-carboxamide
CID 172675207
4-(Aminomethyl)-tetrahydroisoquinolinone
CID 135563818
1-Oxotetrahydroisoquinoline-4-carboxamide
CID 135563821
4-[1-(4,4,4-trifluorobutanoyl)piperidin-4-yl]-1H-pyridin-2-one
CID 145931550
N-[(6-oxo-1H-pyridin-3-yl)methyl]-1-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 146122958
3-[(3S,4R)-1-acetyl-4-fluoro-3-methylpiperidin-4-yl]-5-chloro-1H-pyridin-2-one
CID 166124877
3-[1-(4-aminobutanoyl)-4-fluoro-3-methylpiperidin-4-yl]-5-chloro-1H-pyridin-2-one
CID 171560660

Frequently Asked Questions

What is the IUPAC name of 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide?
The IUPAC name of 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide (CID 142705525) is 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide.
What is the SMILES notation for 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide?
The canonical SMILES for 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide is Cn1ccc(C2CCNCC2C(N)=O)cc1=O.
What is the InChIKey of 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide?
The InChIKey is AODYMGIZMKXMKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O2/c1-15-5-3-8(6-11(15)16)9-2-4-14-7-10(9)12(13)17/h3,5-6,9-10,14H,2,4,7H2,1H3,(H2,13,17).
What are the key properties of 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide?
4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide has a molecular weight of 235.29 g/mol, XLogP of -0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-methyl-2-oxo-4-pyridinyl)piperidine-3-carboxamide is sourced from PubChem (CID 142705525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).