1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide

C15H14FN3O2 — CID 175763959

IUPAC1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide
SMILESNC(=O)c1cn(CC2CC2)cc(-c2ccc(F)cn2)c1=O
InChIInChI=1S/C15H14FN3O2/c16-10-3-4-13(18-5-10)11-7-19(6-9-1-2-9)8-12(14(11)20)15(17)21/h3-5,7-9H,1-2,6H2,(H2,17,21)
InChIKeyALCQKTLVKIYGET-UHFFFAOYSA-N
MW287.29 g/mol
LogP1.56
Rot. Bonds4

About 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide

1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide (PubChem CID 175763959) has the molecular formula C15H14FN3O2 and a molecular weight of 287.29 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide
PubChem CID175763959
Molecular FormulaC15H14FN3O2
Molecular Weight287.29 g/mol
Exact Mass287.11
IUPAC Name1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide
SMILESNC(=O)c1cn(CC2CC2)cc(-c2ccc(F)cn2)c1=O
InChIInChI=1S/C15H14FN3O2/c16-10-3-4-13(18-5-10)11-7-19(6-9-1-2-9)8-12(14(11)20)15(17)21/h3-5,7-9H,1-2,6H2,(H2,17,21)
InChIKeyALCQKTLVKIYGET-UHFFFAOYSA-N
XLogP1.56
TPSA77.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.29
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-chloropyridazin-3-yl)-5-(5-methyl-2-pyridinyl)-1-(oxan-4-ylmethyl)-4-oxopyridine-3-carboxamide
CID 129135110
5-(4-fluorophenyl)-N-(6-methyl-3-pyridinyl)-1-(oxan-4-ylmethyl)-4-oxopyridine-3-carboxamide
CID 129300479
N-[6-[2-amino-5-[4-[[(2R)-1,4-dioxan-2-yl]methoxy]-3-methoxyphenyl]-3-pyridinyl]pyridazin-3-yl]-5-(4-fluorophenyl)-1-(oxan-4-ylmethyl)-4-oxopyridine-3-carboxamide
CID 129135107
3-(5-fluoro-2-pyridinyl)-1-methylpyrazole-5-carboxamide
CID 140673910
3-[2-[6-[2-amino-5-(3,4-dimethoxyphenyl)-3-pyridinyl]pyridazin-3-yl]acetyl]-5-(4-methylphenyl)-1-(oxan-4-ylmethyl)pyridin-4-one
CID 157301275
2-(5-fluoro-2-pyridinyl)benzoic acid
CID 131357741
2-(cyclopropylmethoxy)-4-fluorobenzamide
CID 70194943
5-(4-fluorophenyl)-4-oxo-1-pyridin-3-ylpyridine-3-carboxamide
CID 175770992
3-[2-[6-[2-amino-5-[1-(oxan-4-yl)pyrazol-4-yl]-3-pyridinyl]-3-pyridinyl]acetyl]-5-(4-methylphenyl)-1-(oxan-4-ylmethyl)pyridin-4-one
CID 160698229
4-[1-(cyclopropylmethyl)imidazol-4-yl]-5-(4-fluorophenyl)-2H-triazole
CID 172843445
N-[4-[2-amino-5-[4-[[(2S)-1,4-dioxan-2-yl]methoxy]-3-hydroxyphenyl]-3-pyridinyl]-3-fluorophenyl]-5-(5-methyl-2-pyridinyl)-1-(oxan-4-ylmethyl)-4-oxopyridine-3-carboxamide
CID 118657286
N-[4-[3-amino-5-[4-[(3R)-1-[(3-hydroxycyclobutyl)methyl]-2-oxopyrrolidin-3-yl]oxyphenyl]-2-pyridinyl]-3-fluorophenyl]-1-(cyclobutylmethyl)-5-(5-methyl-2-pyridinyl)-4-oxopyridine-3-carboxamide
CID 164578995

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide?
The IUPAC name of 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide (CID 175763959) is 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide is NC(=O)c1cn(CC2CC2)cc(-c2ccc(F)cn2)c1=O.
What is the InChIKey of 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide?
The InChIKey is ALCQKTLVKIYGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2/c16-10-3-4-13(18-5-10)11-7-19(6-9-1-2-9)8-12(14(11)20)15(17)21/h3-5,7-9H,1-2,6H2,(H2,17,21).
What are the key properties of 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide?
1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide has a molecular weight of 287.29 g/mol, XLogP of 1.56, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-5-(5-fluoro-2-pyridinyl)-4-oxopyridine-3-carboxamide is sourced from PubChem (CID 175763959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).