6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide

C12H16N4O2 — CID 62180415

IUPAC6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NC2CCCNC2=O)cn1
InChIInChI=1S/C12H16N4O2/c1-13-10-5-4-8(7-15-10)11(17)16-9-3-2-6-14-12(9)18/h4-5,7,9H,2-3,6H2,1H3,(H,13,15)(H,14,18)(H,16,17)
InChIKeyOUPJDLPWOFRHHH-UHFFFAOYSA-N
MW248.29 g/mol
LogP0.13
Rot. Bonds3

About 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide

6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide (PubChem CID 62180415) has the molecular formula C12H16N4O2 and a molecular weight of 248.29 g/mol. Its IUPAC name is 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide
PubChem CID62180415
Molecular FormulaC12H16N4O2
Molecular Weight248.29 g/mol
Exact Mass248.13
IUPAC Name6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NC2CCCNC2=O)cn1
InChIInChI=1S/C12H16N4O2/c1-13-10-5-4-8(7-15-10)11(17)16-9-3-2-6-14-12(9)18/h4-5,7,9H,2-3,6H2,1H3,(H,13,15)(H,14,18)(H,16,17)
InChIKeyOUPJDLPWOFRHHH-UHFFFAOYSA-N
XLogP0.13
TPSA83.12 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.29
LogP ≤ 50.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-(dimethylamino)-N-(2-oxoazepan-3-yl)pyridine-3-carboxamide
CID 56817220
6-[(2-oxopiperidin-3-yl)carbamoyl]pyridine-3-carboxylic acid
CID 62092824
4-[[(3S)-2-oxopiperidin-3-yl]carbamoyl]benzoic acid
CID 94349391
4-chloro-N-(2-oxopiperidin-3-yl)benzamide
CID 3531239
N-[(3S)-2-oxoazepan-3-yl]-2-pyridin-4-ylpyrimidine-5-carboxamide
CID 97198109
1-N-[(3S)-2-oxopiperidin-3-yl]-2-N-[(3R)-2-oxopiperidin-3-yl]benzene-1,2-dicarboxamide
CID 26791100
5-hydroxy-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide
CID 55258653
6-(methylamino)-N-(3-methylcyclohexyl)pyridine-3-carboxamide
CID 62168135
5-methyl-N-(2-oxopiperidin-3-yl)-1H-pyrazole-4-carboxamide
CID 62192755
5-hydroxy-2-methyl-N-[(3S)-2-oxopiperidin-3-yl]pyridine-4-carboxamide
CID 125446782
4-butyl-N-[(3R)-2-oxopiperidin-3-yl]benzamide
CID 54765874
2-(aminomethyl)-N-(2-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 114326439

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide (CID 62180415) is 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide is CNc1ccc(C(=O)NC2CCCNC2=O)cn1.
What is the InChIKey of 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide?
The InChIKey is OUPJDLPWOFRHHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O2/c1-13-10-5-4-8(7-15-10)11(17)16-9-3-2-6-14-12(9)18/h4-5,7,9H,2-3,6H2,1H3,(H,13,15)(H,14,18)(H,16,17).
What are the key properties of 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide?
6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide has a molecular weight of 248.29 g/mol, XLogP of 0.13, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-(2-oxopiperidin-3-yl)pyridine-3-carboxamide is sourced from PubChem (CID 62180415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).