5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide

C25H26FN3O2 — CID 74318068

IUPAC5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1O)c1cnc(CCc2cccnc2)c(-c2ccc(F)cc2)c1
InChIInChI=1S/C25H26FN3O2/c26-20-10-8-18(9-11-20)21-14-19(25(31)29-23-5-1-2-6-24(23)30)16-28-22(21)12-7-17-4-3-13-27-15-17/h3-4,8-11,13-16,23-24,30H,1-2,5-7,12H2,(H,29,31)
InChIKeySUFOKWQASIIERS-UHFFFAOYSA-N
MW419.50 g/mol
LogP4.10
Rot. Bonds6

About 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide

5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide (PubChem CID 74318068) has the molecular formula C25H26FN3O2 and a molecular weight of 419.50 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
PubChem CID74318068
Molecular FormulaC25H26FN3O2
Molecular Weight419.50 g/mol
Exact Mass419.20
IUPAC Name5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
SMILESO=C(NC1CCCCC1O)c1cnc(CCc2cccnc2)c(-c2ccc(F)cc2)c1
InChIInChI=1S/C25H26FN3O2/c26-20-10-8-18(9-11-20)21-14-19(25(31)29-23-5-1-2-6-24(23)30)16-28-22(21)12-7-17-4-3-13-27-15-17/h3-4,8-11,13-16,23-24,30H,1-2,5-7,12H2,(H,29,31)
InChIKeySUFOKWQASIIERS-UHFFFAOYSA-N
XLogP4.10
TPSA75.11 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.50
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-2-ylethyl)pyridine-3-carboxamide
CID 74318085
5-(4-chlorophenyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-6-[2-(1-hydroxycyclopentyl)ethyl]pyridine-3-carboxamide
CID 67504838
5-(4-chlorophenyl)-N-[(2R)-2-cyclopropyl-2-hydroxypropyl]-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide
CID 24797445
1-(2-hydroxycyclohexyl)-3-(2-pyridin-3-ylethyl)urea
CID 110933231
5-(4-chlorophenyl)-N-[(1S,2R)-2-hydroxycyclohexyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 67971298
5-(4-chlorophenyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 11952383
5-(4-chlorophenyl)-N-(2-hydroxycyclohexyl)-6-(pyridin-2-ylmethoxy)pyridine-3-carboxamide
CID 21109622
5-(4-chlorophenyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-6-(pyridin-2-ylmethoxy)pyridine-3-carboxamide
CID 24856919
6-(5-amino-5-oxopentoxy)-5-(4-chlorophenyl)-N-(2-hydroxycyclohexyl)pyridine-3-carboxamide
CID 21109644
5-(3,4-dichlorophenyl)-N-[(2R)-2-hydroxycyclohexyl]-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 146505274
5-(4-chlorophenyl)-N-[(2R)-2-hydroxycyclohexyl]-6-[(2S)-2-methoxypropoxy]pyridine-3-carboxamide
CID 67505139
5-(4-chlorophenyl)-N-[(1R,2R)-2-hydroxycyclohexyl]-6-[(2S)-2-methoxypropoxy]pyridine-3-carboxamide
CID 67505140

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide (CID 74318068) is 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide is O=C(NC1CCCCC1O)c1cnc(CCc2cccnc2)c(-c2ccc(F)cc2)c1.
What is the InChIKey of 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
The InChIKey is SUFOKWQASIIERS-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H26FN3O2/c26-20-10-8-18(9-11-20)21-14-19(25(31)29-23-5-1-2-6-24(23)30)16-28-22(21)12-7-17-4-3-13-27-15-17/h3-4,8-11,13-16,23-24,30H,1-2,5-7,12H2,(H,29,31).
What are the key properties of 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide?
5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide has a molecular weight of 419.50 g/mol, XLogP of 4.10, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-(2-hydroxycyclohexyl)-6-(2-pyridin-3-ylethyl)pyridine-3-carboxamide is sourced from PubChem (CID 74318068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).