3-(cyclopentylamino)propanoic acid

C8H15NO2 — CID 16768971

IUPAC3-(cyclopentylamino)propanoic acid
SMILESO=C(O)CCNC1CCCC1
InChIInChI=1S/C8H15NO2/c10-8(11)5-6-9-7-3-1-2-4-7/h7,9H,1-6H2,(H,10,11)
InChIKeyMWKAFAOTXUBGKV-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.99
Rot. Bonds4

About 3-(cyclopentylamino)propanoic acid

3-(cyclopentylamino)propanoic acid (PubChem CID 16768971) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 3-(cyclopentylamino)propanoic acid.

Molecular Properties

Compound Name3-(cyclopentylamino)propanoic acid
PubChem CID16768971
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name3-(cyclopentylamino)propanoic acid
SMILESO=C(O)CCNC1CCCC1
InChIInChI=1S/C8H15NO2/c10-8(11)5-6-9-7-3-1-2-4-7/h7,9H,1-6H2,(H,10,11)
InChIKeyMWKAFAOTXUBGKV-UHFFFAOYSA-N
XLogP0.99
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 3-(cyclopentylamino)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-(cyclopentylamino)propanoic acid?
The IUPAC name of 3-(cyclopentylamino)propanoic acid (CID 16768971) is 3-(cyclopentylamino)propanoic acid.
What is the SMILES notation for 3-(cyclopentylamino)propanoic acid?
The canonical SMILES for 3-(cyclopentylamino)propanoic acid is O=C(O)CCNC1CCCC1.
What is the InChIKey of 3-(cyclopentylamino)propanoic acid?
The InChIKey is MWKAFAOTXUBGKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c10-8(11)5-6-9-7-3-1-2-4-7/h7,9H,1-6H2,(H,10,11).
What are the key properties of 3-(cyclopentylamino)propanoic acid?
3-(cyclopentylamino)propanoic acid has a molecular weight of 157.21 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 3-(cyclopentylamino)propanoic acid is sourced from PubChem (CID 16768971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).