1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid

C14H17NO4 — CID 43151448

IUPAC1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1cccc(C(=O)NC2(C(=O)O)CCCC2)c1
InChIInChI=1S/C14H17NO4/c1-19-11-6-4-5-10(9-11)12(16)15-14(13(17)18)7-2-3-8-14/h4-6,9H,2-3,7-8H2,1H3,(H,15,16)(H,17,18)
InChIKeyYANULQKLYKBGBG-UHFFFAOYSA-N
MW263.29 g/mol
LogP1.82
Rot. Bonds4

About 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid

1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 43151448) has the molecular formula C14H17NO4 and a molecular weight of 263.29 g/mol. Its IUPAC name is 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
PubChem CID43151448
Molecular FormulaC14H17NO4
Molecular Weight263.29 g/mol
Exact Mass263.12
IUPAC Name1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1cccc(C(=O)NC2(C(=O)O)CCCC2)c1
InChIInChI=1S/C14H17NO4/c1-19-11-6-4-5-10(9-11)12(16)15-14(13(17)18)7-2-3-8-14/h4-6,9H,2-3,7-8H2,1H3,(H,15,16)(H,17,18)
InChIKeyYANULQKLYKBGBG-UHFFFAOYSA-N
XLogP1.82
TPSA75.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.29
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[[3-(2-methoxyethoxy)benzoyl]amino]cycloheptane-1-carboxylic acid
CID 120538657
1-[(3-ethoxybenzoyl)amino]cycloheptane-1-carboxylic acid
CID 120539178
3-[(3-methoxybenzoyl)amino]oxolane-3-carboxylic acid
CID 64888035
1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43351073
N-[1-(hydroxymethyl)cyclopropyl]-3-methoxybenzamide
CID 115764584
3-methoxy-N-(1-phenylcyclobutyl)benzamide
CID 51273020
N-(1-cyanocycloheptyl)-3-methoxybenzamide
CID 60967258
1-[(3-methoxy-4-methylbenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158397
1-[[3-(dimethylcarbamoyl)benzoyl]amino]cyclopentane-1-carboxylic acid
CID 119350549
1-[(3-fluoro-4-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43351057
1-[(3-fluoro-4-methoxybenzoyl)amino]cycloheptane-1-carboxylic acid
CID 120538673
1-[[3-(trifluoromethyl)benzoyl]amino]cyclopentane-1-carboxylic acid
CID 43329574

Frequently Asked Questions

What is the IUPAC name of 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid (CID 43151448) is 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid is COc1cccc(C(=O)NC2(C(=O)O)CCCC2)c1.
What is the InChIKey of 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is YANULQKLYKBGBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO4/c1-19-11-6-4-5-10(9-11)12(16)15-14(13(17)18)7-2-3-8-14/h4-6,9H,2-3,7-8H2,1H3,(H,15,16)(H,17,18).
What are the key properties of 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 263.29 g/mol, XLogP of 1.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43151448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).