(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol

C11H18N2O — CID 165441976

IUPAC(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol
SMILESCC(C)(C)n1nc(CO)cc1C1CC1
InChIInChI=1S/C11H18N2O/c1-11(2,3)13-10(8-4-5-8)6-9(7-14)12-13/h6,8,14H,4-5,7H2,1-3H3
InChIKeyUEACXUSQRMQLIS-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.01
Rot. Bonds2

About (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol

(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol (PubChem CID 165441976) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol
PubChem CID165441976
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol
SMILESCC(C)(C)n1nc(CO)cc1C1CC1
InChIInChI=1S/C11H18N2O/c1-11(2,3)13-10(8-4-5-8)6-9(7-14)12-13/h6,8,14H,4-5,7H2,1-3H3
InChIKeyUEACXUSQRMQLIS-UHFFFAOYSA-N
XLogP2.01
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol?
The IUPAC name of (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol (CID 165441976) is (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol.
What is the SMILES notation for (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol?
The canonical SMILES for (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol is CC(C)(C)n1nc(CO)cc1C1CC1.
What is the InChIKey of (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol?
The InChIKey is UEACXUSQRMQLIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-11(2,3)13-10(8-4-5-8)6-9(7-14)12-13/h6,8,14H,4-5,7H2,1-3H3.
What are the key properties of (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol?
(1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol has a molecular weight of 194.28 g/mol, XLogP of 2.01, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-tert-butyl-5-cyclopropylpyrazol-3-yl)methanol is sourced from PubChem (CID 165441976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).