N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide

C19H16FN3O2 — CID 160904999

IUPACN-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide
SMILESCn1cc(C(=O)NCc2cccc(F)c2)cc(-c2ccccn2)c1=O
InChIInChI=1S/C19H16FN3O2/c1-23-12-14(10-16(19(23)25)17-7-2-3-8-21-17)18(24)22-11-13-5-4-6-15(20)9-13/h2-10,12H,11H2,1H3,(H,22,24)
InChIKeySQAFIIIYSIAVOX-UHFFFAOYSA-N
MW337.35 g/mol
LogP2.52
Rot. Bonds4

About N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide

N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide (PubChem CID 160904999) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide
PubChem CID160904999
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC NameN-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide
SMILESCn1cc(C(=O)NCc2cccc(F)c2)cc(-c2ccccn2)c1=O
InChIInChI=1S/C19H16FN3O2/c1-23-12-14(10-16(19(23)25)17-7-2-3-8-21-17)18(24)22-11-13-5-4-6-15(20)9-13/h2-10,12H,11H2,1H3,(H,22,24)
InChIKeySQAFIIIYSIAVOX-UHFFFAOYSA-N
XLogP2.52
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-fluorophenyl)methyl]-1-methyl-2-oxopyridine-4-carboxamide
CID 103612084
2-N,4-N-bis[(3-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 10293185
N-[(3-fluorophenyl)methyl]-3-(2-methylimidazo[4,5-b]pyridin-3-yl)benzamide
CID 20916290
1-N-[(4-fluorophenyl)methyl]-3-N-(pyridin-2-ylmethyl)benzene-1,3-dicarboxamide
CID 109054659
3-fluoro-N-[(3-fluorophenyl)methyl]-4-(3-hydroxy-2-pyridinyl)benzamide
CID 143032440
N-[(3-fluorophenyl)methyl]-3,5-dimethoxy-4-methylbenzamide
CID 52570640
6-chloro-N-[(3-fluorophenyl)methyl]pyridine-3-carboxamide
CID 24903422
N-[(3-fluorophenyl)methyl]-4-sulfanylbenzamide
CID 107022080
3-[[(3-fluorobenzoyl)amino]methyl]benzoic acid
CID 60893305
3-fluoro-N-[(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl]benzamide
CID 108748855
N-[(3-fluorophenyl)methyl]-6-pyridin-3-ylpyridine-3-carboxamide
CID 71841647
N-[(3-methoxyphenyl)methyl]-4-pyridin-2-ylbenzamide
CID 59673307

Frequently Asked Questions

What is the IUPAC name of N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide?
The IUPAC name of N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide (CID 160904999) is N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide.
What is the SMILES notation for N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide?
The canonical SMILES for N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide is Cn1cc(C(=O)NCc2cccc(F)c2)cc(-c2ccccn2)c1=O.
What is the InChIKey of N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide?
The InChIKey is SQAFIIIYSIAVOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-23-12-14(10-16(19(23)25)17-7-2-3-8-21-17)18(24)22-11-13-5-4-6-15(20)9-13/h2-10,12H,11H2,1H3,(H,22,24).
What are the key properties of N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide?
N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide has a molecular weight of 337.35 g/mol, XLogP of 2.52, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide is sourced from PubChem (CID 160904999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).