5-(aminomethyl)-1H-pyrazol-3-amine

C4H8N4 — CID 83845336

IUPAC5-(aminomethyl)-1H-pyrazol-3-amine
SMILESNCc1cc(N)n[nH]1
InChIInChI=1S/C4H8N4/c5-2-3-1-4(6)8-7-3/h1H,2,5H2,(H3,6,7,8)
InChIKeyRBRHGIKDXINFLY-UHFFFAOYSA-N
MW112.14 g/mol
LogP-0.55
Rot. Bonds1

About 5-(aminomethyl)-1H-pyrazol-3-amine

5-(aminomethyl)-1H-pyrazol-3-amine (PubChem CID 83845336) has the molecular formula C4H8N4 and a molecular weight of 112.14 g/mol. Its IUPAC name is 5-(aminomethyl)-1H-pyrazol-3-amine.

Molecular Properties

Compound Name5-(aminomethyl)-1H-pyrazol-3-amine
PubChem CID83845336
Molecular FormulaC4H8N4
Molecular Weight112.14 g/mol
Exact Mass112.07
IUPAC Name5-(aminomethyl)-1H-pyrazol-3-amine
SMILESNCc1cc(N)n[nH]1
InChIInChI=1S/C4H8N4/c5-2-3-1-4(6)8-7-3/h1H,2,5H2,(H3,6,7,8)
InChIKeyRBRHGIKDXINFLY-UHFFFAOYSA-N
XLogP-0.55
TPSA80.72 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.14
LogP ≤ 5-0.55
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-(aminomethyl)-1H-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-(aminomethyl)-1H-pyrazol-3-amine?
The IUPAC name of 5-(aminomethyl)-1H-pyrazol-3-amine (CID 83845336) is 5-(aminomethyl)-1H-pyrazol-3-amine.
What is the SMILES notation for 5-(aminomethyl)-1H-pyrazol-3-amine?
The canonical SMILES for 5-(aminomethyl)-1H-pyrazol-3-amine is NCc1cc(N)n[nH]1.
What is the InChIKey of 5-(aminomethyl)-1H-pyrazol-3-amine?
The InChIKey is RBRHGIKDXINFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N4/c5-2-3-1-4(6)8-7-3/h1H,2,5H2,(H3,6,7,8).
What are the key properties of 5-(aminomethyl)-1H-pyrazol-3-amine?
5-(aminomethyl)-1H-pyrazol-3-amine has a molecular weight of 112.14 g/mol, XLogP of -0.55, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-1H-pyrazol-3-amine is sourced from PubChem (CID 83845336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).