1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one

C15H14FNO2 — CID 54676757

IUPAC1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one
SMILESO=c1c(Cc2ccc(F)cc2)c(O)ccn1C1CC1
InChIInChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)9-13-14(18)7-8-17(15(13)19)12-5-6-12/h1-4,7-8,12,18H,5-6,9H2
InChIKeyYOARALDHKFYYHF-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.62
Rot. Bonds3

About 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one

1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one (PubChem CID 54676757) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one.

Molecular Properties

Compound Name1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one
PubChem CID54676757
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC Name1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one
SMILESO=c1c(Cc2ccc(F)cc2)c(O)ccn1C1CC1
InChIInChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)9-13-14(18)7-8-17(15(13)19)12-5-6-12/h1-4,7-8,12,18H,5-6,9H2
InChIKeyYOARALDHKFYYHF-UHFFFAOYSA-N
XLogP2.62
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one?
The IUPAC name of 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one (CID 54676757) is 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one.
What is the SMILES notation for 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one?
The canonical SMILES for 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one is O=c1c(Cc2ccc(F)cc2)c(O)ccn1C1CC1.
What is the InChIKey of 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one?
The InChIKey is YOARALDHKFYYHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c16-11-3-1-10(2-4-11)9-13-14(18)7-8-17(15(13)19)12-5-6-12/h1-4,7-8,12,18H,5-6,9H2.
What are the key properties of 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one?
1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one has a molecular weight of 259.28 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[(4-fluorophenyl)methyl]-4-hydroxypyridin-2-one is sourced from PubChem (CID 54676757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).