(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol

C13H15ClN2O — CID 107562168

IUPAC(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(C)c(Cl)c2)n(C)n1
InChIInChI=1S/C13H15ClN2O/c1-8-4-5-10(7-11(8)14)13(17)12-6-9(2)15-16(12)3/h4-7,13,17H,1-3H3
InChIKeyFDFLBDRUXDLZIP-UHFFFAOYSA-N
MW250.73 g/mol
LogP2.77
Rot. Bonds2

About (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol

(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol (PubChem CID 107562168) has the molecular formula C13H15ClN2O and a molecular weight of 250.73 g/mol. Its IUPAC name is (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol
PubChem CID107562168
Molecular FormulaC13H15ClN2O
Molecular Weight250.73 g/mol
Exact Mass250.09
IUPAC Name(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(C)c(Cl)c2)n(C)n1
InChIInChI=1S/C13H15ClN2O/c1-8-4-5-10(7-11(8)14)13(17)12-6-9(2)15-16(12)3/h4-7,13,17H,1-3H3
InChIKeyFDFLBDRUXDLZIP-UHFFFAOYSA-N
XLogP2.77
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.73
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-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

(2,5-dimethylpyrazol-3-yl)-phenylmethanol
CID 105076375
N-[(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methyl]ethanamine
CID 107561717
N-[(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methyl]propan-1-amine
CID 107561653
(3-chloro-4-methylphenyl)-(1-methylpyrazol-3-yl)methanol
CID 103138629
(2,5-dimethylpyrazol-3-yl)-(2-ethylpyrazol-3-yl)methanol
CID 105098174
(3-chloro-4-methylphenyl)-(1-methylimidazol-2-yl)methanol
CID 63195009
(4-bromo-3-chlorophenyl)-(3-chloro-4-methylphenyl)methanol
CID 107562230
1-(3-chloro-4-methylphenyl)-3-(1,3,5-trimethylpyrazol-4-yl)propan-1-ol
CID 107562206
(3-chloro-4-methylphenyl)-(4-fluoro-3,5-dimethylphenyl)methanol
CID 65296780
(2-tert-butyl-1,3-thiazol-4-yl)-(3-chloro-4-methylphenyl)methanol
CID 107559682
(3-chloro-4-methylphenyl)-(3-chloro-2-pyridinyl)methanol
CID 107560175
5-[(3-chloro-4-methylphenyl)-hydroxymethyl]furan-2-carboxylic acid
CID 106946508

Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol?
The IUPAC name of (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol (CID 107562168) is (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol.
What is the SMILES notation for (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol?
The canonical SMILES for (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol is Cc1cc(C(O)c2ccc(C)c(Cl)c2)n(C)n1.
What is the InChIKey of (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol?
The InChIKey is FDFLBDRUXDLZIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15ClN2O/c1-8-4-5-10(7-11(8)14)13(17)12-6-9(2)15-16(12)3/h4-7,13,17H,1-3H3.
What are the key properties of (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol?
(3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol has a molecular weight of 250.73 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-methylphenyl)-(2,5-dimethylpyrazol-3-yl)methanol is sourced from PubChem (CID 107562168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).