2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid

C16H21NO3 — CID 60827106

IUPAC2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid
SMILESCc1ccccc1CC(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-15(18)17(11-16(19)20)14-8-4-5-9-14/h2-3,6-7,14H,4-5,8-11H2,1H3,(H,19,20)
InChIKeyZDWYSHKVVZIZEB-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.39
Rot. Bonds5

About 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid

2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid (PubChem CID 60827106) has the molecular formula C16H21NO3 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid.

Molecular Properties

Compound Name2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid
PubChem CID60827106
Molecular FormulaC16H21NO3
Molecular Weight275.35 g/mol
Exact Mass275.15
IUPAC Name2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid
SMILESCc1ccccc1CC(=O)N(CC(=O)O)C1CCCC1
InChIInChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-15(18)17(11-16(19)20)14-8-4-5-9-14/h2-3,6-7,14H,4-5,8-11H2,1H3,(H,19,20)
InChIKeyZDWYSHKVVZIZEB-UHFFFAOYSA-N
XLogP2.39
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic 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

N-cyclopentyl-N-(2-hydroxyethyl)-2-(2-methylphenyl)acetamide
CID 54994021
2-[cyclopentyl-(2-phenylacetyl)amino]acetic acid
CID 54926378
N-(2-bromoethyl)-N-cyclohexyl-2-(2-methylphenyl)acetamide
CID 80659112
2-[[2-(2-bromophenyl)acetyl]-cyclopropylamino]acetic acid
CID 119194508
2-[cyclopropyl-[2-(7-methyl-1H-indol-3-yl)acetyl]amino]acetic acid
CID 119194873
2-[cyclopentyl-(2-pyridin-4-ylacetyl)amino]acetic acid
CID 60826593
2-[cyclopentyl-[(2,3-dimethylphenyl)methyl]amino]acetic acid
CID 65058304
2-[cyclobutyl-[2-(3-methoxy-4-methylphenyl)acetyl]amino]acetic acid
CID 146135252
2-(2-methylphenyl)acetic acid
CID 67440217
N-(3-amino-3-sulfanylidenepropyl)-N-cyclopropyl-2-(2-methylphenyl)acetamide
CID 54996507
2-[cyclopentyl-[methyl(phenyl)carbamoyl]amino]acetic acid
CID 61186503
N-(2-aminoethyl)-N-cyclopentyl-2-(2-hydroxyphenyl)acetamide
CID 80743733

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid?
The IUPAC name of 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid (CID 60827106) is 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid.
What is the SMILES notation for 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid?
The canonical SMILES for 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid is Cc1ccccc1CC(=O)N(CC(=O)O)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid?
The InChIKey is ZDWYSHKVVZIZEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-15(18)17(11-16(19)20)14-8-4-5-9-14/h2-3,6-7,14H,4-5,8-11H2,1H3,(H,19,20).
What are the key properties of 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid?
2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid has a molecular weight of 275.35 g/mol, XLogP of 2.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[2-(2-methylphenyl)acetyl]amino]acetic acid is sourced from PubChem (CID 60827106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).