(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol

C14H24N2O — CID 124512855

IUPAC(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCC(C)C1CCC([C@@H](O)c2ccnn2C)CC1
InChIInChI=1S/C14H24N2O/c1-10(2)11-4-6-12(7-5-11)14(17)13-8-9-15-16(13)3/h8-12,14,17H,4-7H2,1-3H3/t11?,12?,14-/m1/s1
InChIKeyWBUYSTBAJVPGLO-ORHYLEIMSA-N
MW236.36 g/mol
LogP2.92
Rot. Bonds3

About (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol

(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol (PubChem CID 124512855) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol.

Molecular Properties

Compound Name(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol
PubChem CID124512855
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol
SMILESCC(C)C1CCC([C@@H](O)c2ccnn2C)CC1
InChIInChI=1S/C14H24N2O/c1-10(2)11-4-6-12(7-5-11)14(17)13-8-9-15-16(13)3/h8-12,14,17H,4-7H2,1-3H3/t11?,12?,14-/m1/s1
InChIKeyWBUYSTBAJVPGLO-ORHYLEIMSA-N
XLogP2.92
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The IUPAC name of (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol (CID 124512855) is (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol.
What is the SMILES notation for (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The canonical SMILES for (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol is CC(C)C1CCC([C@@H](O)c2ccnn2C)CC1.
What is the InChIKey of (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
The InChIKey is WBUYSTBAJVPGLO-ORHYLEIMSA-N. The full InChI is InChI=1S/C14H24N2O/c1-10(2)11-4-6-12(7-5-11)14(17)13-8-9-15-16(13)3/h8-12,14,17H,4-7H2,1-3H3/t11?,12?,14-/m1/s1.
What are the key properties of (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol?
(R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol has a molecular weight of 236.36 g/mol, XLogP of 2.92, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-(2-methylpyrazol-3-yl)-(4-propan-2-ylcyclohexyl)methanol is sourced from PubChem (CID 124512855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).