(4-chloro-2-pyrazol-1-ylphenyl)methanol

C10H9ClN2O — CID 114845909

IUPAC(4-chloro-2-pyrazol-1-ylphenyl)methanol
SMILESOCc1ccc(Cl)cc1-n1cccn1
InChIInChI=1S/C10H9ClN2O/c11-9-3-2-8(7-14)10(6-9)13-5-1-4-12-13/h1-6,14H,7H2
InChIKeyBUZXZUQOWFHQGV-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.02
Rot. Bonds2

About (4-chloro-2-pyrazol-1-ylphenyl)methanol

(4-chloro-2-pyrazol-1-ylphenyl)methanol (PubChem CID 114845909) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is (4-chloro-2-pyrazol-1-ylphenyl)methanol.

Molecular Properties

Compound Name(4-chloro-2-pyrazol-1-ylphenyl)methanol
PubChem CID114845909
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name(4-chloro-2-pyrazol-1-ylphenyl)methanol
SMILESOCc1ccc(Cl)cc1-n1cccn1
InChIInChI=1S/C10H9ClN2O/c11-9-3-2-8(7-14)10(6-9)13-5-1-4-12-13/h1-6,14H,7H2
InChIKeyBUZXZUQOWFHQGV-UHFFFAOYSA-N
XLogP2.02
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chloro-2-pyrazol-1-ylphenyl)methyl]ethanamine
CID 114854091
1-(4-chloro-2-pyrrolidin-1-ylphenyl)pyrazole
CID 168514990
1-[5-bromo-2-(chloromethyl)phenyl]pyrazole
CID 43365163
N-(5-chloro-2-pyrazol-1-ylphenyl)-2,2-difluoroacetamide
CID 103515148
(5-chloro-2-pyrrol-1-ylphenyl)methanol
CID 86239932
[4-chloro-2-(2-propylimidazol-1-yl)phenyl]methanol
CID 114845946
diethyl 2-(5-chloro-2-pyrazol-1-ylphenyl)propanedioate
CID 71723825
[5-chloro-2-(2-pyrazol-1-ylethoxy)phenyl]methanol
CID 54961991
ethyl N-(5-chloro-2-pyrazol-1-ylphenyl)carbamate
CID 61062622
2-[2-(5-chloro-2-pyrazol-1-ylanilino)-2-oxoethyl]sulfanylacetic acid
CID 104569143
N-(5-chloro-2-pyrazol-1-ylphenyl)-3-(ethylamino)-2-methylpropanamide
CID 62852915
ethane;(2-methyl-5-pyrazol-1-ylphenyl)methanol
CID 143966234

Frequently Asked Questions

What is the IUPAC name of (4-chloro-2-pyrazol-1-ylphenyl)methanol?
The IUPAC name of (4-chloro-2-pyrazol-1-ylphenyl)methanol (CID 114845909) is (4-chloro-2-pyrazol-1-ylphenyl)methanol.
What is the SMILES notation for (4-chloro-2-pyrazol-1-ylphenyl)methanol?
The canonical SMILES for (4-chloro-2-pyrazol-1-ylphenyl)methanol is OCc1ccc(Cl)cc1-n1cccn1.
What is the InChIKey of (4-chloro-2-pyrazol-1-ylphenyl)methanol?
The InChIKey is BUZXZUQOWFHQGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c11-9-3-2-8(7-14)10(6-9)13-5-1-4-12-13/h1-6,14H,7H2.
What are the key properties of (4-chloro-2-pyrazol-1-ylphenyl)methanol?
(4-chloro-2-pyrazol-1-ylphenyl)methanol has a molecular weight of 208.65 g/mol, XLogP of 2.02, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-2-pyrazol-1-ylphenyl)methanol is sourced from PubChem (CID 114845909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).