4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine

C12H24N4 — CID 43296122

IUPAC4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine
SMILESCCC(C)CN(C)c1c(CN)c(C)nn1C
InChIInChI=1S/C12H24N4/c1-6-9(2)8-15(4)12-11(7-13)10(3)14-16(12)5/h9H,6-8,13H2,1-5H3
InChIKeyIPPOEYCECGXSPJ-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.67
Rot. Bonds5

About 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine

4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine (PubChem CID 43296122) has the molecular formula C12H24N4 and a molecular weight of 224.35 g/mol. Its IUPAC name is 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine.

Molecular Properties

Compound Name4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine
PubChem CID43296122
Molecular FormulaC12H24N4
Molecular Weight224.35 g/mol
Exact Mass224.20
IUPAC Name4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine
SMILESCCC(C)CN(C)c1c(CN)c(C)nn1C
InChIInChI=1S/C12H24N4/c1-6-9(2)8-15(4)12-11(7-13)10(3)14-16(12)5/h9H,6-8,13H2,1-5H3
InChIKeyIPPOEYCECGXSPJ-UHFFFAOYSA-N
XLogP1.67
TPSA47.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-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 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine?
The IUPAC name of 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine (CID 43296122) is 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine.
What is the SMILES notation for 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine?
The canonical SMILES for 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine is CCC(C)CN(C)c1c(CN)c(C)nn1C.
What is the InChIKey of 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine?
The InChIKey is IPPOEYCECGXSPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N4/c1-6-9(2)8-15(4)12-11(7-13)10(3)14-16(12)5/h9H,6-8,13H2,1-5H3.
What are the key properties of 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine?
4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine has a molecular weight of 224.35 g/mol, XLogP of 1.67, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N,1,3-trimethyl-N-(2-methylbutyl)pyrazol-5-amine is sourced from PubChem (CID 43296122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).