4-propan-2-yl-1H-pyrazol-5-amine

C6H11N3 — CID 19002201

IUPAC4-propan-2-yl-1H-pyrazol-5-amine
SMILESCC(C)c1cn[nH]c1N
InChIInChI=1S/C6H11N3/c1-4(2)5-3-8-9-6(5)7/h3-4H,1-2H3,(H3,7,8,9)
InChIKeyUQTLFNBARWAWIS-UHFFFAOYSA-N
MW125.17 g/mol
LogP1.12
Rot. Bonds1

About 4-propan-2-yl-1H-pyrazol-5-amine

4-propan-2-yl-1H-pyrazol-5-amine (PubChem CID 19002201) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is 4-propan-2-yl-1H-pyrazol-5-amine.

Molecular Properties

Compound Name4-propan-2-yl-1H-pyrazol-5-amine
PubChem CID19002201
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name4-propan-2-yl-1H-pyrazol-5-amine
SMILESCC(C)c1cn[nH]c1N
InChIInChI=1S/C6H11N3/c1-4(2)5-3-8-9-6(5)7/h3-4H,1-2H3,(H3,7,8,9)
InChIKeyUQTLFNBARWAWIS-UHFFFAOYSA-N
XLogP1.12
TPSA54.70 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-propan-2-yl-1H-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-propan-2-yl-1H-pyrazol-5-amine?
The IUPAC name of 4-propan-2-yl-1H-pyrazol-5-amine (CID 19002201) is 4-propan-2-yl-1H-pyrazol-5-amine.
What is the SMILES notation for 4-propan-2-yl-1H-pyrazol-5-amine?
The canonical SMILES for 4-propan-2-yl-1H-pyrazol-5-amine is CC(C)c1cn[nH]c1N.
What is the InChIKey of 4-propan-2-yl-1H-pyrazol-5-amine?
The InChIKey is UQTLFNBARWAWIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3/c1-4(2)5-3-8-9-6(5)7/h3-4H,1-2H3,(H3,7,8,9).
What are the key properties of 4-propan-2-yl-1H-pyrazol-5-amine?
4-propan-2-yl-1H-pyrazol-5-amine has a molecular weight of 125.17 g/mol, XLogP of 1.12, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-propan-2-yl-1H-pyrazol-5-amine is sourced from PubChem (CID 19002201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).