2-(4-tert-butylcyclohexyl)pyrazol-3-amine

C13H23N3 — CID 16792344

IUPAC2-(4-tert-butylcyclohexyl)pyrazol-3-amine
SMILESCC(C)(C)C1CCC(n2nccc2N)CC1
InChIInChI=1S/C13H23N3/c1-13(2,3)10-4-6-11(7-5-10)16-12(14)8-9-15-16/h8-11H,4-7,14H2,1-3H3
InChIKeyRLBJNQZGKQKTRQ-UHFFFAOYSA-N
MW221.35 g/mol
LogP3.24
Rot. Bonds1

About 2-(4-tert-butylcyclohexyl)pyrazol-3-amine

2-(4-tert-butylcyclohexyl)pyrazol-3-amine (PubChem CID 16792344) has the molecular formula C13H23N3 and a molecular weight of 221.35 g/mol. Its IUPAC name is 2-(4-tert-butylcyclohexyl)pyrazol-3-amine.

Molecular Properties

Compound Name2-(4-tert-butylcyclohexyl)pyrazol-3-amine
PubChem CID16792344
Molecular FormulaC13H23N3
Molecular Weight221.35 g/mol
Exact Mass221.19
IUPAC Name2-(4-tert-butylcyclohexyl)pyrazol-3-amine
SMILESCC(C)(C)C1CCC(n2nccc2N)CC1
InChIInChI=1S/C13H23N3/c1-13(2,3)10-4-6-11(7-5-10)16-12(14)8-9-15-16/h8-11H,4-7,14H2,1-3H3
InChIKeyRLBJNQZGKQKTRQ-UHFFFAOYSA-N
XLogP3.24
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.35
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-tert-butylcyclohexyl)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 2-(4-tert-butylcyclohexyl)pyrazol-3-amine?
The IUPAC name of 2-(4-tert-butylcyclohexyl)pyrazol-3-amine (CID 16792344) is 2-(4-tert-butylcyclohexyl)pyrazol-3-amine.
What is the SMILES notation for 2-(4-tert-butylcyclohexyl)pyrazol-3-amine?
The canonical SMILES for 2-(4-tert-butylcyclohexyl)pyrazol-3-amine is CC(C)(C)C1CCC(n2nccc2N)CC1.
What is the InChIKey of 2-(4-tert-butylcyclohexyl)pyrazol-3-amine?
The InChIKey is RLBJNQZGKQKTRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3/c1-13(2,3)10-4-6-11(7-5-10)16-12(14)8-9-15-16/h8-11H,4-7,14H2,1-3H3.
What are the key properties of 2-(4-tert-butylcyclohexyl)pyrazol-3-amine?
2-(4-tert-butylcyclohexyl)pyrazol-3-amine has a molecular weight of 221.35 g/mol, XLogP of 3.24, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-tert-butylcyclohexyl)pyrazol-3-amine is sourced from PubChem (CID 16792344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).