(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone

C15H10ClN3O — CID 54519483

IUPAC(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)n1cc(-c2ccncc2)cn1
InChIInChI=1S/C15H10ClN3O/c16-14-3-1-12(2-4-14)15(20)19-10-13(9-18-19)11-5-7-17-8-6-11/h1-10H
InChIKeyYOTOUOWMMNTELO-UHFFFAOYSA-N
MW283.72 g/mol
LogP3.29
Rot. Bonds2

About (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone

(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone (PubChem CID 54519483) has the molecular formula C15H10ClN3O and a molecular weight of 283.72 g/mol. Its IUPAC name is (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone.

Molecular Properties

Compound Name(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone
PubChem CID54519483
Molecular FormulaC15H10ClN3O
Molecular Weight283.72 g/mol
Exact Mass283.05
IUPAC Name(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone
SMILESO=C(c1ccc(Cl)cc1)n1cc(-c2ccncc2)cn1
InChIInChI=1S/C15H10ClN3O/c16-14-3-1-12(2-4-14)15(20)19-10-13(9-18-19)11-5-7-17-8-6-11/h1-10H
InChIKeyYOTOUOWMMNTELO-UHFFFAOYSA-N
XLogP3.29
TPSA47.78 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.72
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone 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 (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone?
The IUPAC name of (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone (CID 54519483) is (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone.
What is the SMILES notation for (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone?
The canonical SMILES for (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone is O=C(c1ccc(Cl)cc1)n1cc(-c2ccncc2)cn1.
What is the InChIKey of (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone?
The InChIKey is YOTOUOWMMNTELO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClN3O/c16-14-3-1-12(2-4-14)15(20)19-10-13(9-18-19)11-5-7-17-8-6-11/h1-10H.
What are the key properties of (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone?
(4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone has a molecular weight of 283.72 g/mol, XLogP of 3.29, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-(4-pyridin-4-ylpyrazol-1-yl)methanone is sourced from PubChem (CID 54519483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).