2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid

C16H21NO3 — CID 64670407

IUPAC2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid
SMILESCc1ccccc1CC(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-14(18)17-16(11-15(19)20)8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,17,18)(H,19,20)
InChIKeyLTHGCGUBJUMTNE-UHFFFAOYSA-N
MW275.35 g/mol
LogP2.44
Rot. Bonds5

About 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid

2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid (PubChem CID 64670407) has the molecular formula C16H21NO3 and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid
PubChem CID64670407
Molecular FormulaC16H21NO3
Molecular Weight275.35 g/mol
Exact Mass275.15
IUPAC Name2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid
SMILESCc1ccccc1CC(=O)NC1(CC(=O)O)CCCC1
InChIInChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-14(18)17-16(11-15(19)20)8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,17,18)(H,19,20)
InChIKeyLTHGCGUBJUMTNE-UHFFFAOYSA-N
XLogP2.44
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 52.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-[(2-phenylacetyl)amino]cyclohexyl]acetic acid
CID 64671959
2-[1-[[2-(4-methyl-1H-indol-3-yl)acetyl]amino]cyclobutyl]acetic acid
CID 119218043
2-[1-[[2-(4-aminophenyl)acetyl]amino]cyclopentyl]acetic acid
CID 64700742
2-chloro-N-[1-[(2-methylphenyl)methyl]cyclopentyl]acetamide
CID 82133784
2-[1-[(3-methylpyridine-2-carbonyl)amino]cyclopentyl]acetic acid
CID 64671017
2-[1-[4-(2-methylphenoxy)butanoylamino]cyclobutyl]acetic acid
CID 119218009
2-[1-[(2-pyridin-4-ylacetyl)amino]cyclopentyl]acetic acid
CID 64672788
2-[1-[(2-phenoxyacetyl)amino]cyclopentyl]acetic acid
CID 64673162
2-[1-[(2-pyridin-4-ylacetyl)amino]cyclohexyl]acetic acid
CID 64672336
N-[4-(chloromethyl)oxan-4-yl]-2-(2-methylphenyl)acetamide
CID 114170463
1-[[[2-(2-methylphenyl)acetyl]amino]methyl]cyclopentane-1-carboxylic acid
CID 81367155
2-[1-[[2-(6,7-dimethyl-1-benzofuran-3-yl)acetyl]amino]cyclobutyl]acetic acid
CID 119218085

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid (CID 64670407) is 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid is Cc1ccccc1CC(=O)NC1(CC(=O)O)CCCC1.
What is the InChIKey of 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid?
The InChIKey is LTHGCGUBJUMTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21NO3/c1-12-6-2-3-7-13(12)10-14(18)17-16(11-15(19)20)8-4-5-9-16/h2-3,6-7H,4-5,8-11H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid?
2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid has a molecular weight of 275.35 g/mol, XLogP of 2.44, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[2-(2-methylphenyl)acetyl]amino]cyclopentyl]acetic acid is sourced from PubChem (CID 64670407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).