(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid

C15H24N2O4 — CID 124682258

IUPAC(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid
SMILESCC(=O)N[C@@H](C(=O)N1CC[C@@](C)(C(=O)O)C1)C1CCCC1
InChIInChI=1S/C15H24N2O4/c1-10(18)16-12(11-5-3-4-6-11)13(19)17-8-7-15(2,9-17)14(20)21/h11-12H,3-9H2,1-2H3,(H,16,18)(H,20,21)/t12-,15-/m1/s1
InChIKeyUNXVGEFWCSBTEU-IUODEOHRSA-N
MW296.37 g/mol
LogP1.00
Rot. Bonds4

About (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid

(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid (PubChem CID 124682258) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid.

Molecular Properties

Compound Name(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid
PubChem CID124682258
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid
SMILESCC(=O)N[C@@H](C(=O)N1CC[C@@](C)(C(=O)O)C1)C1CCCC1
InChIInChI=1S/C15H24N2O4/c1-10(18)16-12(11-5-3-4-6-11)13(19)17-8-7-15(2,9-17)14(20)21/h11-12H,3-9H2,1-2H3,(H,16,18)(H,20,21)/t12-,15-/m1/s1
InChIKeyUNXVGEFWCSBTEU-IUODEOHRSA-N
XLogP1.00
TPSA86.71 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-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-(1-cyclohexylethylcarbamoyl)-3-methylpyrrolidine-3-carboxylic acid
CID 63147981
1-[2-(cyclopentanecarbonylamino)propanoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 119257319
1-(3-cyclopentyl-2-methylpropanoyl)-3-methylpyrrolidine-3-carboxylic acid
CID 119256212
1-(cyclooctylcarbamoyl)-3-methylpyrrolidine-3-carboxylic acid
CID 63146003
3-methyl-1-(2-methylpropanoyl)pyrrolidine-3-carboxylic acid
CID 63142722
1-(2-acetamidopropanoyl)-4-methylpiperidine-4-carboxylic acid
CID 55179299
1-(cyclohexanecarbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 55166325
N-[2-[(3R)-3-aminopyrrolidin-1-yl]-1-cyclopentyl-2-oxoethyl]acetamide;hydrochloride
CID 119409783
1-(cyclobutanecarbonyl)-3-methylpyrrolidine-3-carboxylic acid
CID 63143159
3-methylpyrrolidine-1,3-dicarboxylic acid
CID 23111893
1-[[cyclopentyl-(2-fluorophenyl)methyl]carbamoyl]-3-methylpyrrolidine-3-carboxylic acid
CID 122005991
(3R)-1-(2,2-diphenylacetyl)-3-methylpyrrolidine-3-carboxylic acid
CID 124695120

Frequently Asked Questions

What is the IUPAC name of (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid?
The IUPAC name of (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid (CID 124682258) is (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid.
What is the SMILES notation for (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid?
The canonical SMILES for (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid is CC(=O)N[C@@H](C(=O)N1CC[C@@](C)(C(=O)O)C1)C1CCCC1.
What is the InChIKey of (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid?
The InChIKey is UNXVGEFWCSBTEU-IUODEOHRSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-10(18)16-12(11-5-3-4-6-11)13(19)17-8-7-15(2,9-17)14(20)21/h11-12H,3-9H2,1-2H3,(H,16,18)(H,20,21)/t12-,15-/m1/s1.
What are the key properties of (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid?
(3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid has a molecular weight of 296.37 g/mol, XLogP of 1.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-1-[(2R)-2-acetamido-2-cyclopentylacetyl]-3-methylpyrrolidine-3-carboxylic acid is sourced from PubChem (CID 124682258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).