4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide

C19H16FN3O2 — CID 175689187

IUPAC4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide
SMILESCn1ccc(-c2ccc(Cc3cccc(F)c3)cn2)c(C(N)=O)c1=O
InChIInChI=1S/C19H16FN3O2/c1-23-8-7-15(17(18(21)24)19(23)25)16-6-5-13(11-22-16)9-12-3-2-4-14(20)10-12/h2-8,10-11H,9H2,1H3,(H2,21,24)
InChIKeyYANWQPHSHKZSDH-UHFFFAOYSA-N
MW337.35 g/mol
LogP2.28
Rot. Bonds4

About 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide

4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide (PubChem CID 175689187) has the molecular formula C19H16FN3O2 and a molecular weight of 337.35 g/mol. Its IUPAC name is 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide
PubChem CID175689187
Molecular FormulaC19H16FN3O2
Molecular Weight337.35 g/mol
Exact Mass337.12
IUPAC Name4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide
SMILESCn1ccc(-c2ccc(Cc3cccc(F)c3)cn2)c(C(N)=O)c1=O
InChIInChI=1S/C19H16FN3O2/c1-23-8-7-15(17(18(21)24)19(23)25)16-6-5-13(11-22-16)9-12-3-2-4-14(20)10-12/h2-8,10-11H,9H2,1H3,(H2,21,24)
InChIKeyYANWQPHSHKZSDH-UHFFFAOYSA-N
XLogP2.28
TPSA77.98 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 ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[3-ethyl-5-[(3-fluorophenyl)methyl]-2-pyridinyl]pyrazole-3-carboxamide
CID 155600343
4-[(3-fluorophenyl)methyl]pyrazole-1-carboxamide
CID 175706112
(1,3-dimethylpyrazol-4-yl)-[(3S)-3-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]piperidin-1-yl]methanone
CID 92615597
3-[(3-fluorophenyl)methyl]-1-methylpyrazole-5-carboxylic acid
CID 115093000
1-(2-fluoroethyl)-4-[5-[(3-fluorophenyl)methyl]-1,3-thiazol-2-yl]-6-oxopyridazine-3-carboxamide
CID 175689169
N-[(3-fluorophenyl)methyl]-1-methyl-6-oxo-5-pyridin-2-ylpyridine-3-carboxamide
CID 160904999
(2,4-dimethyl-1,3-oxazol-5-yl)-[(2R)-2-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]methanone
CID 92615648
N-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-2,6-dimethylpyrimidine-4-carboxamide
CID 155700089
1-(cyclopropylmethyl)-N-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-6-oxopyridazine-3-carboxamide
CID 139512605
3-[(3-fluorophenyl)methyl]-1-methylpyrazol-5-amine
CID 115092972
3-[3-[(2S)-2-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]pyrrolidin-1-yl]-3-oxopropyl]-5,5-dimethylimidazolidine-2,4-dione
CID 92615627
2-(3-fluorophenyl)-1-(1-methylimidazol-2-yl)ethanol
CID 63976213

Frequently Asked Questions

What is the IUPAC name of 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide?
The IUPAC name of 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide (CID 175689187) is 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide?
The canonical SMILES for 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide is Cn1ccc(-c2ccc(Cc3cccc(F)c3)cn2)c(C(N)=O)c1=O.
What is the InChIKey of 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide?
The InChIKey is YANWQPHSHKZSDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2/c1-23-8-7-15(17(18(21)24)19(23)25)16-6-5-13(11-22-16)9-12-3-2-4-14(20)10-12/h2-8,10-11H,9H2,1H3,(H2,21,24).
What are the key properties of 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide?
4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide has a molecular weight of 337.35 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-[(3-fluorophenyl)methyl]-2-pyridinyl]-1-methyl-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 175689187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).