5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol

C14H24N2O — CID 63960927

IUPAC5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)(c2ccnn2C)C1
InChIInChI=1S/C14H24N2O/c1-10(2)12-6-5-11(3)9-14(12,17)13-7-8-15-16(13)4/h7-8,10-12,17H,5-6,9H2,1-4H3
InChIKeyUEVHMOCPKZTRTJ-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.70
Rot. Bonds2

About 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol

5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol (PubChem CID 63960927) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol
PubChem CID63960927
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol
SMILESCC1CCC(C(C)C)C(O)(c2ccnn2C)C1
InChIInChI=1S/C14H24N2O/c1-10(2)12-6-5-11(3)9-14(12,17)13-7-8-15-16(13)4/h7-8,10-12,17H,5-6,9H2,1-4H3
InChIKeyUEVHMOCPKZTRTJ-UHFFFAOYSA-N
XLogP2.70
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol (CID 63960927) is 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol is CC1CCC(C(C)C)C(O)(c2ccnn2C)C1.
What is the InChIKey of 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol?
The InChIKey is UEVHMOCPKZTRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)12-6-5-11(3)9-14(12,17)13-7-8-15-16(13)4/h7-8,10-12,17H,5-6,9H2,1-4H3.
What are the key properties of 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol?
5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol has a molecular weight of 236.36 g/mol, XLogP of 2.70, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-1-(2-methylpyrazol-3-yl)-2-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 63960927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).