(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol

C15H12ClN3O — CID 107330378

IUPAC(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol
SMILESOC(c1ccc(Cl)nc1)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H12ClN3O/c16-14-7-6-11(10-17-14)15(20)13-8-9-18-19(13)12-4-2-1-3-5-12/h1-10,15,20H
InChIKeyABWSWJGCTOWYRR-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.00
Rot. Bonds3

About (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol

(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol (PubChem CID 107330378) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol
PubChem CID107330378
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol
SMILESOC(c1ccc(Cl)nc1)c1ccnn1-c1ccccc1
InChIInChI=1S/C15H12ClN3O/c16-14-7-6-11(10-17-14)15(20)13-8-9-18-19(13)12-4-2-1-3-5-12/h1-10,15,20H
InChIKeyABWSWJGCTOWYRR-UHFFFAOYSA-N
XLogP3.00
TPSA50.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.73
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze (6-chloro-3-pyridinyl)-(2-phenylpyrazol-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

Related Compounds

(3,4-dichlorophenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107329830
(5-methyl-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol
CID 107332331
(2-aminophenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330329
(2-phenylpyrazol-3-yl)-thiophen-2-ylmethanol
CID 107329836
(3-bromo-5-methylphenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107332266
(2-chloro-4-fluorophenyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330323
(6-methyl-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanamine
CID 107332063
2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330398
2-chloro-2,2-difluoro-1-(2-phenylpyrazol-3-yl)ethanol
CID 107330397
2,3-dimethyl-1-(2-phenylpyrazol-3-yl)butan-1-ol
CID 107332293
(2-methylcyclopropyl)-(2-phenylpyrazol-3-yl)methanol
CID 107330350
(4-chlorophenyl)-(2-methylpyrazol-3-yl)methanol
CID 11550333

Frequently Asked Questions

What is the IUPAC name of (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol?
The IUPAC name of (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol (CID 107330378) is (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol.
What is the SMILES notation for (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol?
The canonical SMILES for (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol is OC(c1ccc(Cl)nc1)c1ccnn1-c1ccccc1.
What is the InChIKey of (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol?
The InChIKey is ABWSWJGCTOWYRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c16-14-7-6-11(10-17-14)15(20)13-8-9-18-19(13)12-4-2-1-3-5-12/h1-10,15,20H.
What are the key properties of (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol?
(6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol has a molecular weight of 285.73 g/mol, XLogP of 3.00, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (6-chloro-3-pyridinyl)-(2-phenylpyrazol-3-yl)methanol is sourced from PubChem (CID 107330378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).