2-(cyclopentylamino)propanoic acid;hydrochloride

C8H16ClNO2 — CID 75493401

IUPAC2-(cyclopentylamino)propanoic acid;hydrochloride
SMILESCC(NC1CCCC1)C(=O)O.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-6(8(10)11)9-7-4-2-3-5-7;/h6-7,9H,2-5H2,1H3,(H,10,11);1H
InChIKeyRFECBSBPSGUZHL-UHFFFAOYSA-N
MW193.67 g/mol
LogP1.41
Rot. Bonds3

About 2-(cyclopentylamino)propanoic acid;hydrochloride

2-(cyclopentylamino)propanoic acid;hydrochloride (PubChem CID 75493401) has the molecular formula C8H16ClNO2 and a molecular weight of 193.67 g/mol. Its IUPAC name is 2-(cyclopentylamino)propanoic acid;hydrochloride.

Molecular Properties

Compound Name2-(cyclopentylamino)propanoic acid;hydrochloride
PubChem CID75493401
Molecular FormulaC8H16ClNO2
Molecular Weight193.67 g/mol
Exact Mass193.09
IUPAC Name2-(cyclopentylamino)propanoic acid;hydrochloride
SMILESCC(NC1CCCC1)C(=O)O.Cl
InChIInChI=1S/C8H15NO2.ClH/c1-6(8(10)11)9-7-4-2-3-5-7;/h6-7,9H,2-5H2,1H3,(H,10,11);1H
InChIKeyRFECBSBPSGUZHL-UHFFFAOYSA-N
XLogP1.41
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.67
LogP ≤ 51.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclopentylamino)propanoic acid;hydrochloride?
The IUPAC name of 2-(cyclopentylamino)propanoic acid;hydrochloride (CID 75493401) is 2-(cyclopentylamino)propanoic acid;hydrochloride.
What is the SMILES notation for 2-(cyclopentylamino)propanoic acid;hydrochloride?
The canonical SMILES for 2-(cyclopentylamino)propanoic acid;hydrochloride is CC(NC1CCCC1)C(=O)O.Cl.
What is the InChIKey of 2-(cyclopentylamino)propanoic acid;hydrochloride?
The InChIKey is RFECBSBPSGUZHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2.ClH/c1-6(8(10)11)9-7-4-2-3-5-7;/h6-7,9H,2-5H2,1H3,(H,10,11);1H.
What are the key properties of 2-(cyclopentylamino)propanoic acid;hydrochloride?
2-(cyclopentylamino)propanoic acid;hydrochloride has a molecular weight of 193.67 g/mol, XLogP of 1.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopentylamino)propanoic acid;hydrochloride is sourced from PubChem (CID 75493401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).