5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine

C18H33N3 — CID 63525726

IUPAC5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine
SMILESCCCCC1CCC(c2nn(C)c(N)c2CC(C)C)CC1
InChIInChI=1S/C18H33N3/c1-5-6-7-14-8-10-15(11-9-14)17-16(12-13(2)3)18(19)21(4)20-17/h13-15H,5-12,19H2,1-4H3
InChIKeyJJEKAERZGWRWMG-UHFFFAOYSA-N
MW291.48 g/mol
LogP4.66
Rot. Bonds6

About 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine

5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine (PubChem CID 63525726) has the molecular formula C18H33N3 and a molecular weight of 291.48 g/mol. Its IUPAC name is 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine.

Molecular Properties

Compound Name5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine
PubChem CID63525726
Molecular FormulaC18H33N3
Molecular Weight291.48 g/mol
Exact Mass291.27
IUPAC Name5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine
SMILESCCCCC1CCC(c2nn(C)c(N)c2CC(C)C)CC1
InChIInChI=1S/C18H33N3/c1-5-6-7-14-8-10-15(11-9-14)17-16(12-13(2)3)18(19)21(4)20-17/h13-15H,5-12,19H2,1-4H3
InChIKeyJJEKAERZGWRWMG-UHFFFAOYSA-N
XLogP4.66
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.48
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine 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 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine?
The IUPAC name of 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine (CID 63525726) is 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine.
What is the SMILES notation for 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine?
The canonical SMILES for 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine is CCCCC1CCC(c2nn(C)c(N)c2CC(C)C)CC1.
What is the InChIKey of 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine?
The InChIKey is JJEKAERZGWRWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H33N3/c1-5-6-7-14-8-10-15(11-9-14)17-16(12-13(2)3)18(19)21(4)20-17/h13-15H,5-12,19H2,1-4H3.
What are the key properties of 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine?
5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine has a molecular weight of 291.48 g/mol, XLogP of 4.66, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-butylcyclohexyl)-2-methyl-4-(2-methylpropyl)pyrazol-3-amine is sourced from PubChem (CID 63525726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).