1-(2-cyclobutyloxyethyl)pyrazol-4-amine

C9H15N3O — CID 62137723

IUPAC1-(2-cyclobutyloxyethyl)pyrazol-4-amine
SMILESNc1cnn(CCOC2CCC2)c1
InChIInChI=1S/C9H15N3O/c10-8-6-11-12(7-8)4-5-13-9-2-1-3-9/h6-7,9H,1-5,10H2
InChIKeyFQNKITJRBFIPTQ-UHFFFAOYSA-N
MW181.24 g/mol
LogP1.03
Rot. Bonds4

About 1-(2-cyclobutyloxyethyl)pyrazol-4-amine

1-(2-cyclobutyloxyethyl)pyrazol-4-amine (PubChem CID 62137723) has the molecular formula C9H15N3O and a molecular weight of 181.24 g/mol. Its IUPAC name is 1-(2-cyclobutyloxyethyl)pyrazol-4-amine.

Molecular Properties

Compound Name1-(2-cyclobutyloxyethyl)pyrazol-4-amine
PubChem CID62137723
Molecular FormulaC9H15N3O
Molecular Weight181.24 g/mol
Exact Mass181.12
IUPAC Name1-(2-cyclobutyloxyethyl)pyrazol-4-amine
SMILESNc1cnn(CCOC2CCC2)c1
InChIInChI=1S/C9H15N3O/c10-8-6-11-12(7-8)4-5-13-9-2-1-3-9/h6-7,9H,1-5,10H2
InChIKeyFQNKITJRBFIPTQ-UHFFFAOYSA-N
XLogP1.03
TPSA53.07 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.24
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-cyclobutyloxyethyl)pyrazol-4-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 1-(2-cyclobutyloxyethyl)pyrazol-4-amine?
The IUPAC name of 1-(2-cyclobutyloxyethyl)pyrazol-4-amine (CID 62137723) is 1-(2-cyclobutyloxyethyl)pyrazol-4-amine.
What is the SMILES notation for 1-(2-cyclobutyloxyethyl)pyrazol-4-amine?
The canonical SMILES for 1-(2-cyclobutyloxyethyl)pyrazol-4-amine is Nc1cnn(CCOC2CCC2)c1.
What is the InChIKey of 1-(2-cyclobutyloxyethyl)pyrazol-4-amine?
The InChIKey is FQNKITJRBFIPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O/c10-8-6-11-12(7-8)4-5-13-9-2-1-3-9/h6-7,9H,1-5,10H2.
What are the key properties of 1-(2-cyclobutyloxyethyl)pyrazol-4-amine?
1-(2-cyclobutyloxyethyl)pyrazol-4-amine has a molecular weight of 181.24 g/mol, XLogP of 1.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-cyclobutyloxyethyl)pyrazol-4-amine is sourced from PubChem (CID 62137723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).