3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid

C9H13N3O2 — CID 83830941

IUPAC3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid
SMILESNC(CC(=O)O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C9H13N3O2/c10-6(3-9(13)14)8-4-7(11-12-8)5-1-2-5/h4-6H,1-3,10H2,(H,11,12)(H,13,14)
InChIKeyAHMKPUQWXUUXNC-UHFFFAOYSA-N
MW195.22 g/mol
LogP0.76
Rot. Bonds4

About 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid

3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid (PubChem CID 83830941) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid.

Molecular Properties

Compound Name3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid
PubChem CID83830941
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC Name3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid
SMILESNC(CC(=O)O)c1cc(C2CC2)[nH]n1
InChIInChI=1S/C9H13N3O2/c10-6(3-9(13)14)8-4-7(11-12-8)5-1-2-5/h4-6H,1-3,10H2,(H,11,12)(H,13,14)
InChIKeyAHMKPUQWXUUXNC-UHFFFAOYSA-N
XLogP0.76
TPSA92.00 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid 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 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid?
The IUPAC name of 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid (CID 83830941) is 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid.
What is the SMILES notation for 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid?
The canonical SMILES for 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid is NC(CC(=O)O)c1cc(C2CC2)[nH]n1.
What is the InChIKey of 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid?
The InChIKey is AHMKPUQWXUUXNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c10-6(3-9(13)14)8-4-7(11-12-8)5-1-2-5/h4-6H,1-3,10H2,(H,11,12)(H,13,14).
What are the key properties of 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid?
3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid has a molecular weight of 195.22 g/mol, XLogP of 0.76, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-(5-cyclopropyl-1H-pyrazol-3-yl)propanoic acid is sourced from PubChem (CID 83830941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).