N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide

C12H15N3O3 — CID 64668240

IUPACN-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCN1CC(NC(=O)c2ccc(=O)[nH]c2)CCC1=O
InChIInChI=1S/C12H15N3O3/c1-15-7-9(3-5-11(15)17)14-12(18)8-2-4-10(16)13-6-8/h2,4,6,9H,3,5,7H2,1H3,(H,13,16)(H,14,18)
InChIKeyWSDKYBZXAFFURK-UHFFFAOYSA-N
MW249.27 g/mol
LogP-0.27
Rot. Bonds2

About N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide

N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 64668240) has the molecular formula C12H15N3O3 and a molecular weight of 249.27 g/mol. Its IUPAC name is N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID64668240
Molecular FormulaC12H15N3O3
Molecular Weight249.27 g/mol
Exact Mass249.11
IUPAC NameN-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide
SMILESCN1CC(NC(=O)c2ccc(=O)[nH]c2)CCC1=O
InChIInChI=1S/C12H15N3O3/c1-15-7-9(3-5-11(15)17)14-12(18)8-2-4-10(16)13-6-8/h2,4,6,9H,3,5,7H2,1H3,(H,13,16)(H,14,18)
InChIKeyWSDKYBZXAFFURK-UHFFFAOYSA-N
XLogP-0.27
TPSA82.27 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 ≤ 5-0.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-methyl-6-oxopiperidin-3-yl)-1,2,3,4-tetrahydroquinoxaline-6-carboxamide
CID 104615091
3,5-dihydroxy-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 103892579
4-amino-3-fluoro-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64655889
N-(1-methyl-6-oxopiperidin-3-yl)-1H-indazole-6-carboxamide
CID 64667250
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 64667254
N-[(3R)-1-methyl-6-oxopiperidin-3-yl]-4-(piperidin-1-ylmethyl)benzamide
CID 97196232
N-[(3S)-1-methyl-6-oxopiperidin-3-yl]-1H-imidazole-5-carboxamide
CID 125130512
N-(1-butylpiperidin-4-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 47363948
2-bromo-N-(1-methyl-6-oxopiperidin-3-yl)pyridine-4-carboxamide
CID 103752814
4-[(6-oxo-1H-pyridine-3-carbonyl)amino]cyclohexane-1-carboxylic acid
CID 60808216
2-amino-N-(1-methyl-6-oxopiperidin-3-yl)benzamide
CID 64655074
2-bromo-N-(1-methyl-6-oxopiperidin-3-yl)furan-3-carboxamide
CID 106854038

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide (CID 64668240) is N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide is CN1CC(NC(=O)c2ccc(=O)[nH]c2)CCC1=O.
What is the InChIKey of N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is WSDKYBZXAFFURK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O3/c1-15-7-9(3-5-11(15)17)14-12(18)8-2-4-10(16)13-6-8/h2,4,6,9H,3,5,7H2,1H3,(H,13,16)(H,14,18).
What are the key properties of N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide?
N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 249.27 g/mol, XLogP of -0.27, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-6-oxopiperidin-3-yl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 64668240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).