[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol

C17H22N2O2 — CID 64785535

IUPAC[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol
SMILESCc1ccc(OCc2ccn(C3CCCC3)n2)c(CO)c1
InChIInChI=1S/C17H22N2O2/c1-13-6-7-17(14(10-13)11-20)21-12-15-8-9-19(18-15)16-4-2-3-5-16/h6-10,16,20H,2-5,11-12H2,1H3
InChIKeyUZQTVCMQARIDQX-UHFFFAOYSA-N
MW286.38 g/mol
LogP3.38
Rot. Bonds5

About [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol

[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol (PubChem CID 64785535) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol.

Molecular Properties

Compound Name[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol
PubChem CID64785535
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol
SMILESCc1ccc(OCc2ccn(C3CCCC3)n2)c(CO)c1
InChIInChI=1S/C17H22N2O2/c1-13-6-7-17(14(10-13)11-20)21-12-15-8-9-19(18-15)16-4-2-3-5-16/h6-10,16,20H,2-5,11-12H2,1H3
InChIKeyUZQTVCMQARIDQX-UHFFFAOYSA-N
XLogP3.38
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanamine
CID 64800598
1-cyclohexyl-3-[(2-ethylphenoxy)methyl]pyrazole
CID 64779347
3-[[2-(chloromethyl)phenoxy]methyl]-1-cyclohexylpyrazole
CID 64784762
[3-chloro-4-[(1-cyclopentylpyrazol-3-yl)methoxy]phenyl]methanamine
CID 64801737
3-[[4-(bromomethyl)-2-chlorophenoxy]methyl]-1-cyclopentylpyrazole
CID 64785349
3-[(2-bromo-4-fluorophenoxy)methyl]-1-cyclohexylpyrazole
CID 64801690
[2-(cyclopentylmethoxy)-5-methylphenyl]methanol
CID 63325672
1-(2-bromo-4-methylphenyl)-2-(1-cyclopentylpyrazol-3-yl)ethanone
CID 114977452
3-[(1-cyclohexylpyrazol-3-yl)methoxy]-6-fluoropyridine-2-carbonitrile
CID 167879327
ethyl 5-[(1-cyclopentylpyrazol-3-yl)methoxy]-1H-pyrazole-4-carboxylate
CID 167988724
(2-cyclobutyloxy-5-methylphenyl)methanol
CID 84664151
1-[(1-cyclohexylpyrazol-3-yl)methyl]-4-methylpyridin-2-one
CID 116622567

Frequently Asked Questions

What is the IUPAC name of [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol?
The IUPAC name of [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol (CID 64785535) is [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol.
What is the SMILES notation for [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol?
The canonical SMILES for [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol is Cc1ccc(OCc2ccn(C3CCCC3)n2)c(CO)c1.
What is the InChIKey of [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol?
The InChIKey is UZQTVCMQARIDQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-13-6-7-17(14(10-13)11-20)21-12-15-8-9-19(18-15)16-4-2-3-5-16/h6-10,16,20H,2-5,11-12H2,1H3.
What are the key properties of [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol?
[2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol has a molecular weight of 286.38 g/mol, XLogP of 3.38, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(1-cyclopentylpyrazol-3-yl)methoxy]-5-methylphenyl]methanol is sourced from PubChem (CID 64785535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).