2-cyclopropyl-2-(cyclopropylamino)propanoic acid

C9H15NO2 — CID 43754464

IUPAC2-cyclopropyl-2-(cyclopropylamino)propanoic acid
SMILESCC(NC1CC1)(C(=O)O)C1CC1
InChIInChI=1S/C9H15NO2/c1-9(8(11)12,6-2-3-6)10-7-4-5-7/h6-7,10H,2-5H2,1H3,(H,11,12)
InChIKeyJAAWIOGIWZKELE-UHFFFAOYSA-N
MW169.22 g/mol
LogP0.99
Rot. Bonds4

About 2-cyclopropyl-2-(cyclopropylamino)propanoic acid

2-cyclopropyl-2-(cyclopropylamino)propanoic acid (PubChem CID 43754464) has the molecular formula C9H15NO2 and a molecular weight of 169.22 g/mol. Its IUPAC name is 2-cyclopropyl-2-(cyclopropylamino)propanoic acid.

Molecular Properties

Compound Name2-cyclopropyl-2-(cyclopropylamino)propanoic acid
PubChem CID43754464
Molecular FormulaC9H15NO2
Molecular Weight169.22 g/mol
Exact Mass169.11
IUPAC Name2-cyclopropyl-2-(cyclopropylamino)propanoic acid
SMILESCC(NC1CC1)(C(=O)O)C1CC1
InChIInChI=1S/C9H15NO2/c1-9(8(11)12,6-2-3-6)10-7-4-5-7/h6-7,10H,2-5H2,1H3,(H,11,12)
InChIKeyJAAWIOGIWZKELE-UHFFFAOYSA-N
XLogP0.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.22
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-cyclopropyl-2-(cyclopropylamino)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 2-cyclopropyl-2-(cyclopropylamino)propanoic acid?
The IUPAC name of 2-cyclopropyl-2-(cyclopropylamino)propanoic acid (CID 43754464) is 2-cyclopropyl-2-(cyclopropylamino)propanoic acid.
What is the SMILES notation for 2-cyclopropyl-2-(cyclopropylamino)propanoic acid?
The canonical SMILES for 2-cyclopropyl-2-(cyclopropylamino)propanoic acid is CC(NC1CC1)(C(=O)O)C1CC1.
What is the InChIKey of 2-cyclopropyl-2-(cyclopropylamino)propanoic acid?
The InChIKey is JAAWIOGIWZKELE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15NO2/c1-9(8(11)12,6-2-3-6)10-7-4-5-7/h6-7,10H,2-5H2,1H3,(H,11,12).
What are the key properties of 2-cyclopropyl-2-(cyclopropylamino)propanoic acid?
2-cyclopropyl-2-(cyclopropylamino)propanoic acid has a molecular weight of 169.22 g/mol, XLogP of 0.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropyl-2-(cyclopropylamino)propanoic acid is sourced from PubChem (CID 43754464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).