3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol

C11H18N2O — CID 63960928

IUPAC3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol
SMILESCC1CCCC(O)(c2ccnn2C)C1
InChIInChI=1S/C11H18N2O/c1-9-4-3-6-11(14,8-9)10-5-7-12-13(10)2/h5,7,9,14H,3-4,6,8H2,1-2H3
InChIKeyUADDHENYBCGFPH-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.82
Rot. Bonds1

About 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol

3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol (PubChem CID 63960928) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol
PubChem CID63960928
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol
SMILESCC1CCCC(O)(c2ccnn2C)C1
InChIInChI=1S/C11H18N2O/c1-9-4-3-6-11(14,8-9)10-5-7-12-13(10)2/h5,7,9,14H,3-4,6,8H2,1-2H3
InChIKeyUADDHENYBCGFPH-UHFFFAOYSA-N
XLogP1.82
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol?
The IUPAC name of 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol (CID 63960928) is 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol.
What is the SMILES notation for 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol?
The canonical SMILES for 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol is CC1CCCC(O)(c2ccnn2C)C1.
What is the InChIKey of 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol?
The InChIKey is UADDHENYBCGFPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-4-3-6-11(14,8-9)10-5-7-12-13(10)2/h5,7,9,14H,3-4,6,8H2,1-2H3.
What are the key properties of 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol?
3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(2-methylpyrazol-3-yl)cyclohexan-1-ol is sourced from PubChem (CID 63960928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).