[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol

C15H12ClN3O — CID 5146729

IUPAC[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol
SMILESOCc1cn(-c2cccc(Cl)c2)nc1-c1cccnc1
InChIInChI=1S/C15H12ClN3O/c16-13-4-1-5-14(7-13)19-9-12(10-20)15(18-19)11-3-2-6-17-8-11/h1-9,20H,10H2
InChIKeyQDBLXKPDLOBYPB-UHFFFAOYSA-N
MW285.73 g/mol
LogP3.08
Rot. Bonds3

About [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol

[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol (PubChem CID 5146729) has the molecular formula C15H12ClN3O and a molecular weight of 285.73 g/mol. Its IUPAC name is [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol
PubChem CID5146729
Molecular FormulaC15H12ClN3O
Molecular Weight285.73 g/mol
Exact Mass285.07
IUPAC Name[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol
SMILESOCc1cn(-c2cccc(Cl)c2)nc1-c1cccnc1
InChIInChI=1S/C15H12ClN3O/c16-13-4-1-5-14(7-13)19-9-12(10-20)15(18-19)11-3-2-6-17-8-11/h1-9,20H,10H2
InChIKeyQDBLXKPDLOBYPB-UHFFFAOYSA-N
XLogP3.08
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 ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)methylamino]ethanol
CID 17445531
N-[(3-chlorophenyl)methyl]-N-methyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 22110546
3-(4-chloro-1-phenylpyrazol-3-yl)pyridine
CID 141352949
[1-(2-fluoroethyl)-3-pyridin-3-ylpyrazol-4-yl]methanol
CID 121213336
1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 883433
2-[1-(3-chlorophenyl)-3-methylpyrazol-4-yl]ethanol
CID 116817765
1-(3-chlorophenyl)-3-phenylpyrazole-4-carbonitrile
CID 97182239
N,N-diethyl-1-phenyl-3-pyridin-3-ylpyrazole-4-carboxamide
CID 1087057
[3-(4-bromophenyl)-1-(3-methylphenyl)pyrazol-4-yl]methanol
CID 4995785
3-(1,3-diphenylpyrazol-4-yl)pyridine
CID 166447662
1-(3-chlorophenyl)-3-pyridin-3-yl-5,6,7,8-tetrahydro-4H-pyrazolo[5,4-b]azepine
CID 4572183
[1-(4-chlorophenyl)-3-(4-methylphenyl)pyrazol-4-yl]methanol
CID 3820549

Frequently Asked Questions

What is the IUPAC name of [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol?
The IUPAC name of [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol (CID 5146729) is [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol.
What is the SMILES notation for [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol?
The canonical SMILES for [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol is OCc1cn(-c2cccc(Cl)c2)nc1-c1cccnc1.
What is the InChIKey of [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol?
The InChIKey is QDBLXKPDLOBYPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN3O/c16-13-4-1-5-14(7-13)19-9-12(10-20)15(18-19)11-3-2-6-17-8-11/h1-9,20H,10H2.
What are the key properties of [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol?
[1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol has a molecular weight of 285.73 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chlorophenyl)-3-pyridin-3-ylpyrazol-4-yl]methanol is sourced from PubChem (CID 5146729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).