2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid

C14H16ClNO3 — CID 64812051

IUPAC2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccccc1Cl)NC1CCCC1C(=O)O
InChIInChI=1S/C14H16ClNO3/c15-11-6-2-1-4-9(11)8-13(17)16-12-7-3-5-10(12)14(18)19/h1-2,4,6,10,12H,3,5,7-8H2,(H,16,17)(H,18,19)
InChIKeyLIPQKTHFMHJTJL-UHFFFAOYSA-N
MW281.74 g/mol
LogP2.25
Rot. Bonds4

About 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid

2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 64812051) has the molecular formula C14H16ClNO3 and a molecular weight of 281.74 g/mol. Its IUPAC name is 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID64812051
Molecular FormulaC14H16ClNO3
Molecular Weight281.74 g/mol
Exact Mass281.08
IUPAC Name2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid
SMILESO=C(Cc1ccccc1Cl)NC1CCCC1C(=O)O
InChIInChI=1S/C14H16ClNO3/c15-11-6-2-1-4-9(11)8-13(17)16-12-7-3-5-10(12)14(18)19/h1-2,4,6,10,12H,3,5,7-8H2,(H,16,17)(H,18,19)
InChIKeyLIPQKTHFMHJTJL-UHFFFAOYSA-N
XLogP2.25
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.74
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromocyclopentyl)-2-(2-chlorophenyl)acetamide
CID 80662926
2-[[2-[2-(aminomethyl)phenyl]acetyl]amino]cyclopentane-1-carboxylic acid
CID 81322034
2-(2-chlorophenyl)-N-(2-methylcyclohexyl)acetamide
CID 51166113
2-[[2-(3-chlorophenyl)acetyl]amino]cyclohexane-1-carboxylic acid
CID 64813756
N-[(1R,2R,4R)-2-bicyclo[2.2.1]heptanyl]-2-(2-chlorophenyl)acetamide
CID 100631226
2-[(2-chlorophenyl)methyl]cyclohexane-1-carboxylic acid
CID 81008869
2-[(2,3-dichlorobenzoyl)amino]cyclopentane-1-carboxylic acid
CID 64813494
2-[(2-fluorophenyl)methylcarbamoylamino]cyclopentane-1-carboxylic acid
CID 64818051
2-[3-(2-methylphenyl)propanoylamino]cyclohexane-1-carboxylic acid
CID 64812084
2-[(2-pyridin-3-ylacetyl)amino]cyclopentane-1-carboxylic acid
CID 64813919
trans-(1R,2R)-2-[[2-(2,5-dimethylphenyl)acetyl]amino]cyclopentane-1-carboxylic acid
CID 95363924
2-benzamidocyclopentane-1-carboxylic acid
CID 64812220

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid (CID 64812051) is 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid is O=C(Cc1ccccc1Cl)NC1CCCC1C(=O)O.
What is the InChIKey of 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is LIPQKTHFMHJTJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClNO3/c15-11-6-2-1-4-9(11)8-13(17)16-12-7-3-5-10(12)14(18)19/h1-2,4,6,10,12H,3,5,7-8H2,(H,16,17)(H,18,19).
What are the key properties of 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid?
2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 281.74 g/mol, XLogP of 2.25, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(2-chlorophenyl)acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 64812051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).