1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid

C14H22N2O4 — CID 119355100

IUPAC1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid
SMILESCC(NC(=O)C1CCCC1)C(=O)N1CCC(C(=O)O)C1
InChIInChI=1S/C14H22N2O4/c1-9(15-12(17)10-4-2-3-5-10)13(18)16-7-6-11(8-16)14(19)20/h9-11H,2-8H2,1H3,(H,15,17)(H,19,20)
InChIKeySHRHKXWOGHNYDC-UHFFFAOYSA-N
MW282.34 g/mol
LogP0.61
Rot. Bonds4

About 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid

1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid (PubChem CID 119355100) has the molecular formula C14H22N2O4 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid
PubChem CID119355100
Molecular FormulaC14H22N2O4
Molecular Weight282.34 g/mol
Exact Mass282.16
IUPAC Name1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid
SMILESCC(NC(=O)C1CCCC1)C(=O)N1CCC(C(=O)O)C1
InChIInChI=1S/C14H22N2O4/c1-9(15-12(17)10-4-2-3-5-10)13(18)16-7-6-11(8-16)14(19)20/h9-11H,2-8H2,1H3,(H,15,17)(H,19,20)
InChIKeySHRHKXWOGHNYDC-UHFFFAOYSA-N
XLogP0.61
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(cyclopentanecarbonylamino)propanoyl]piperidine-3-carboxylic acid
CID 119167781
N-(1-oxo-1-piperidin-1-ylpropan-2-yl)cyclopentanecarboxamide
CID 42702289
1-(2-acetamidopropanoyl)piperidine-3-carboxylic acid
CID 43355771
(3R)-1-[2-(carbamoylamino)propanoyl]piperidine-3-carboxylic acid
CID 81118974
(3R)-1-[2-(2,2-dimethylpropanoylamino)propanoyl]piperidine-3-carboxylic acid
CID 81118861
N-[1-[4-(1-aminoethyl)piperidin-1-yl]-1-oxopropan-2-yl]cyclopentanecarboxamide
CID 154863211
N-[1-oxo-1-(3-piperazin-1-ylpyrrolidin-1-yl)propan-2-yl]cyclopentanecarboxamide
CID 120994849
1-[2-(cyclopentanecarbonylamino)propanoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 119257319
N-[(2S)-1-(4-amino-3,3-dimethylpiperidin-1-yl)-1-oxopropan-2-yl]cyclohexanecarboxamide;hydrochloride
CID 120820062
2-[4-[2-(cyclopentanecarbonylamino)propanoyl]morpholin-2-yl]acetic acid
CID 119248775
(3S,4S)-1-[2-(cyclopentanecarbonylamino)propanoyl]-4-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 120951840
1-[2-[2-(cyclopentanecarbonylamino)propanoyl-methylamino]acetyl]piperidine-4-carboxylic acid
CID 119236335

Frequently Asked Questions

What is the IUPAC name of 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid?
The IUPAC name of 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid (CID 119355100) is 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid.
What is the SMILES notation for 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid?
The canonical SMILES for 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid is CC(NC(=O)C1CCCC1)C(=O)N1CCC(C(=O)O)C1.
What is the InChIKey of 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid?
The InChIKey is SHRHKXWOGHNYDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O4/c1-9(15-12(17)10-4-2-3-5-10)13(18)16-7-6-11(8-16)14(19)20/h9-11H,2-8H2,1H3,(H,15,17)(H,19,20).
What are the key properties of 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid?
1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid has a molecular weight of 282.34 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(cyclopentanecarbonylamino)propanoyl]pyrrolidine-3-carboxylic acid is sourced from PubChem (CID 119355100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).