1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol

C17H21FN2O — CID 64783669

IUPAC1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccn(C2CCCC2)n1)c1ccccc1F
InChIInChI=1S/C17H21FN2O/c1-17(21,15-8-4-5-9-16(15)18)12-13-10-11-20(19-13)14-6-2-3-7-14/h4-5,8-11,14,21H,2-3,6-7,12H2,1H3
InChIKeyDOLPVCJULATSDN-UHFFFAOYSA-N
MW288.37 g/mol
LogP3.59
Rot. Bonds4

About 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol

1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol (PubChem CID 64783669) has the molecular formula C17H21FN2O and a molecular weight of 288.37 g/mol. Its IUPAC name is 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol.

Molecular Properties

Compound Name1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol
PubChem CID64783669
Molecular FormulaC17H21FN2O
Molecular Weight288.37 g/mol
Exact Mass288.16
IUPAC Name1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol
SMILESCC(O)(Cc1ccn(C2CCCC2)n1)c1ccccc1F
InChIInChI=1S/C17H21FN2O/c1-17(21,15-8-4-5-9-16(15)18)12-13-10-11-20(19-13)14-6-2-3-7-14/h4-5,8-11,14,21H,2-3,6-7,12H2,1H3
InChIKeyDOLPVCJULATSDN-UHFFFAOYSA-N
XLogP3.59
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.37
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-cyclopentylpyrazol-3-yl)-2-phenylbutan-2-ol
CID 64783095
1-(1-cyclohexylpyrazol-3-yl)-2,3-dimethylpentan-2-ol
CID 64784256
3-(3-bromo-2,2-dimethylpropyl)-1-cyclohexylpyrazole
CID 66050139
2-[(1-cyclohexylpyrazol-3-yl)methyl]-2-methylbutanenitrile
CID 65377026
2-[(1-cyclopentylpyrazol-3-yl)methyl]-2-methylbutan-1-amine
CID 64779672
3-[2,2-bis(chloromethyl)-3-methylbutyl]-1-cyclopentylpyrazole
CID 79447968
2-(aminomethyl)-3-(1-cyclohexylpyrazol-3-yl)-2-methylpropanoic acid
CID 106487284
1-(1-cyclopentylpyrazol-3-yl)-2-(4-methylphenyl)propan-2-amine
CID 64784289
2-(1-cyclopentylpyrazol-3-yl)-1-(2,6-difluorophenyl)ethanamine
CID 79515283
3-(1-cyclopentylpyrazol-3-yl)-N-ethyl-2,2-dimethylpropan-1-amine
CID 64777905
1-cyclohexyl-3-ethylpyrazole
CID 66014335
N-[(1-cyclopentylpyrazol-3-yl)methyl]-2-(2-fluorophenyl)ethanamine
CID 64799852

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol?
The IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol (CID 64783669) is 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol.
What is the SMILES notation for 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol?
The canonical SMILES for 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol is CC(O)(Cc1ccn(C2CCCC2)n1)c1ccccc1F.
What is the InChIKey of 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol?
The InChIKey is DOLPVCJULATSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21FN2O/c1-17(21,15-8-4-5-9-16(15)18)12-13-10-11-20(19-13)14-6-2-3-7-14/h4-5,8-11,14,21H,2-3,6-7,12H2,1H3.
What are the key properties of 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol?
1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol has a molecular weight of 288.37 g/mol, XLogP of 3.59, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpyrazol-3-yl)-2-(2-fluorophenyl)propan-2-ol is sourced from PubChem (CID 64783669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).