[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol

C18H12ClFN4O — CID 146662191

IUPAC[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol
SMILESOCc1cnc2ccc(-c3cn[nH]c3-c3cc(Cl)ccc3F)nc2c1
InChIInChI=1S/C18H12ClFN4O/c19-11-1-2-14(20)12(6-11)18-13(8-22-24-18)15-3-4-16-17(23-15)5-10(9-25)7-21-16/h1-8,25H,9H2,(H,22,24)
InChIKeyWIYVVLLMNWKOQR-UHFFFAOYSA-N
MW354.77 g/mol
LogP3.97
Rot. Bonds3

About [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol

[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol (PubChem CID 146662191) has the molecular formula C18H12ClFN4O and a molecular weight of 354.77 g/mol. Its IUPAC name is [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol.

Molecular Properties

Compound Name[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol
PubChem CID146662191
Molecular FormulaC18H12ClFN4O
Molecular Weight354.77 g/mol
Exact Mass354.07
IUPAC Name[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol
SMILESOCc1cnc2ccc(-c3cn[nH]c3-c3cc(Cl)ccc3F)nc2c1
InChIInChI=1S/C18H12ClFN4O/c19-11-1-2-14(20)12(6-11)18-13(8-22-24-18)15-3-4-16-17(23-15)5-10(9-25)7-21-16/h1-8,25H,9H2,(H,22,24)
InChIKeyWIYVVLLMNWKOQR-UHFFFAOYSA-N
XLogP3.97
TPSA74.69 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.77
LogP ≤ 53.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol 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 [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol?
The IUPAC name of [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol (CID 146662191) is [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol.
What is the SMILES notation for [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol?
The canonical SMILES for [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol is OCc1cnc2ccc(-c3cn[nH]c3-c3cc(Cl)ccc3F)nc2c1.
What is the InChIKey of [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol?
The InChIKey is WIYVVLLMNWKOQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H12ClFN4O/c19-11-1-2-14(20)12(6-11)18-13(8-22-24-18)15-3-4-16-17(23-15)5-10(9-25)7-21-16/h1-8,25H,9H2,(H,22,24).
What are the key properties of [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol?
[6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol has a molecular weight of 354.77 g/mol, XLogP of 3.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[5-(5-chloro-2-fluorophenyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]methanol is sourced from PubChem (CID 146662191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).