6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide

C15H14N4O2 — CID 90648386

IUPAC6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide
SMILESN#Cc1ccc(C(=O)NCCCn2ccccc2=O)cn1
InChIInChI=1S/C15H14N4O2/c16-10-13-6-5-12(11-18-13)15(21)17-7-3-9-19-8-2-1-4-14(19)20/h1-2,4-6,8,11H,3,7,9H2,(H,17,21)
InChIKeyHXOVAZSLGOJRON-UHFFFAOYSA-N
MW282.30 g/mol
LogP0.94
Rot. Bonds5

About 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide

6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide (PubChem CID 90648386) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide
PubChem CID90648386
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide
SMILESN#Cc1ccc(C(=O)NCCCn2ccccc2=O)cn1
InChIInChI=1S/C15H14N4O2/c16-10-13-6-5-12(11-18-13)15(21)17-7-3-9-19-8-2-1-4-14(19)20/h1-2,4-6,8,11H,3,7,9H2,(H,17,21)
InChIKeyHXOVAZSLGOJRON-UHFFFAOYSA-N
XLogP0.94
TPSA87.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-(azepan-1-ylmethyl)-N-[3-(2-oxo-1-pyridinyl)propyl]benzamide
CID 90652688
4-bromo-N-[3-(2-oxo-1-pyridinyl)propyl]-1H-pyrazole-5-carboxamide
CID 56787757
3-methoxy-N-[4-(2-oxo-1-pyridinyl)butyl]-4-phenylmethoxybenzamide
CID 86885388
N-[4-(2-oxo-1-pyridinyl)butyl]-1H-indazole-3-carboxamide
CID 60598282
6-(dimethylamino)-N-(3-indol-1-ylpropyl)pyridine-3-carboxamide
CID 71942372
3-(4-methylphenyl)-N-[3-(2-oxo-1-pyridinyl)propyl]-1H-pyrazole-5-carboxamide
CID 119066173
6-cyano-N-[(4-ethylphenyl)methyl]pyridine-3-carboxamide
CID 67567287
6-cyano-N-(pyrazolo[1,5-a]pyrimidin-3-ylmethyl)pyridine-3-carboxamide
CID 90651357
4-(6-cyano-3-pyridinyl)-N-[3-[(2R)-2-(hydroxymethyl)piperidin-1-yl]propyl]benzamide
CID 126437733
1-[2-(2-oxo-1-pyridinyl)ethyl]imidazole-2-carbonitrile
CID 82908033
3-(benzylsulfamoyl)-N-[4-(2-oxo-1-pyridinyl)butyl]benzamide
CID 60598425
2-[3-(2-oxo-1-pyridinyl)propoxy]benzonitrile
CID 43289161

Frequently Asked Questions

What is the IUPAC name of 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide?
The IUPAC name of 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide (CID 90648386) is 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide?
The canonical SMILES for 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide is N#Cc1ccc(C(=O)NCCCn2ccccc2=O)cn1.
What is the InChIKey of 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide?
The InChIKey is HXOVAZSLGOJRON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c16-10-13-6-5-12(11-18-13)15(21)17-7-3-9-19-8-2-1-4-14(19)20/h1-2,4-6,8,11H,3,7,9H2,(H,17,21).
What are the key properties of 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide?
6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide has a molecular weight of 282.30 g/mol, XLogP of 0.94, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyano-N-[3-(2-oxo-1-pyridinyl)propyl]pyridine-3-carboxamide is sourced from PubChem (CID 90648386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).