1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one

C24H23FN2O3 — CID 172659354

IUPAC1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one
SMILESCc1ccn(-c2ccc(F)cc2)c(=O)c1C(=O)N1CCC(c2ccc(O)cc2)CC1
InChIInChI=1S/C24H23FN2O3/c1-16-10-15-27(20-6-4-19(25)5-7-20)24(30)22(16)23(29)26-13-11-18(12-14-26)17-2-8-21(28)9-3-17/h2-10,15,18,28H,11-14H2,1H3
InChIKeyIBMSSVXFARGOFJ-UHFFFAOYSA-N
MW406.46 g/mol
LogP4.01
Rot. Bonds3

About 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one

1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one (PubChem CID 172659354) has the molecular formula C24H23FN2O3 and a molecular weight of 406.46 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one
PubChem CID172659354
Molecular FormulaC24H23FN2O3
Molecular Weight406.46 g/mol
Exact Mass406.17
IUPAC Name1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one
SMILESCc1ccn(-c2ccc(F)cc2)c(=O)c1C(=O)N1CCC(c2ccc(O)cc2)CC1
InChIInChI=1S/C24H23FN2O3/c1-16-10-15-27(20-6-4-19(25)5-7-20)24(30)22(16)23(29)26-13-11-18(12-14-26)17-2-8-21(28)9-3-17/h2-10,15,18,28H,11-14H2,1H3
InChIKeyIBMSSVXFARGOFJ-UHFFFAOYSA-N
XLogP4.01
TPSA62.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.46
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one?
The IUPAC name of 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one (CID 172659354) is 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one?
The canonical SMILES for 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one is Cc1ccn(-c2ccc(F)cc2)c(=O)c1C(=O)N1CCC(c2ccc(O)cc2)CC1.
What is the InChIKey of 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one?
The InChIKey is IBMSSVXFARGOFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23FN2O3/c1-16-10-15-27(20-6-4-19(25)5-7-20)24(30)22(16)23(29)26-13-11-18(12-14-26)17-2-8-21(28)9-3-17/h2-10,15,18,28H,11-14H2,1H3.
What are the key properties of 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one?
1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one has a molecular weight of 406.46 g/mol, XLogP of 4.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-3-[4-(4-hydroxyphenyl)piperidine-1-carbonyl]-4-methylpyridin-2-one is sourced from PubChem (CID 172659354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).