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

C16H26N2O2 — CID 103560149

IUPAC1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol
SMILESCOC1(CC(O)Cc2ccn(C3CCCC3)n2)CCC1
InChIInChI=1S/C16H26N2O2/c1-20-16(8-4-9-16)12-15(19)11-13-7-10-18(17-13)14-5-2-3-6-14/h7,10,14-15,19H,2-6,8-9,11-12H2,1H3
InChIKeyFOXMIUHOFYXTNY-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.86
Rot. Bonds6

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

1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol (PubChem CID 103560149) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol.

Molecular Properties

Compound Name1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol
PubChem CID103560149
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol
SMILESCOC1(CC(O)Cc2ccn(C3CCCC3)n2)CCC1
InChIInChI=1S/C16H26N2O2/c1-20-16(8-4-9-16)12-15(19)11-13-7-10-18(17-13)14-5-2-3-6-14/h7,10,14-15,19H,2-6,8-9,11-12H2,1H3
InChIKeyFOXMIUHOFYXTNY-UHFFFAOYSA-N
XLogP2.86
TPSA47.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-(1-cyclohexylpyrazol-3-yl)-3-methylsulfonylpropan-2-ol
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3-(1-cyclopentylpyrazol-3-yl)-1,1-diethoxypropan-2-ol
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dimethyl 2-[(1-cyclopentylpyrazol-3-yl)methyl]propanedioate
CID 103972375
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2-(1-cyclohexylpyrazol-3-yl)-1-(1-ethylcyclopentyl)ethanol
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1-(1-cyclopentylpyrazol-3-yl)-4-methylpentane-2,3-diol
CID 103456685
1-(4-bromophenyl)-3-(1-cyclopentylpyrazol-3-yl)propan-2-ol
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1-(1-cyclopentylpyrazol-3-yl)-3-methoxyhexan-2-ol
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CID 116764332

Frequently Asked Questions

What is the IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol?
The IUPAC name of 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol (CID 103560149) is 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol.
What is the SMILES notation for 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol?
The canonical SMILES for 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol is COC1(CC(O)Cc2ccn(C3CCCC3)n2)CCC1.
What is the InChIKey of 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol?
The InChIKey is FOXMIUHOFYXTNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-20-16(8-4-9-16)12-15(19)11-13-7-10-18(17-13)14-5-2-3-6-14/h7,10,14-15,19H,2-6,8-9,11-12H2,1H3.
What are the key properties of 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol?
1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol has a molecular weight of 278.40 g/mol, XLogP of 2.86, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-cyclopentylpyrazol-3-yl)-3-(1-methoxycyclobutyl)propan-2-ol is sourced from PubChem (CID 103560149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).