1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid

C15H19NO5 — CID 43351073

IUPAC1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1ccc(OC)c(C(=O)NC2(C(=O)O)CCCC2)c1
InChIInChI=1S/C15H19NO5/c1-20-10-5-6-12(21-2)11(9-10)13(17)16-15(14(18)19)7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyDBRGADOMOOHFHK-UHFFFAOYSA-N
MW293.32 g/mol
LogP1.83
Rot. Bonds5

About 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid

1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid (PubChem CID 43351073) has the molecular formula C15H19NO5 and a molecular weight of 293.32 g/mol. Its IUPAC name is 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
PubChem CID43351073
Molecular FormulaC15H19NO5
Molecular Weight293.32 g/mol
Exact Mass293.13
IUPAC Name1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid
SMILESCOc1ccc(OC)c(C(=O)NC2(C(=O)O)CCCC2)c1
InChIInChI=1S/C15H19NO5/c1-20-10-5-6-12(21-2)11(9-10)13(17)16-15(14(18)19)7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyDBRGADOMOOHFHK-UHFFFAOYSA-N
XLogP1.83
TPSA84.86 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 51.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2-methoxy-5-methylsulfonylbenzoyl)amino]cyclopentane-1-carboxylic acid
CID 120684633
1-[(2-amino-5-methoxybenzoyl)amino]cyclopropane-1-carboxylic acid
CID 115413408
N-[1-(chloromethyl)cyclohexyl]-2,5-dimethoxybenzamide
CID 114303372
1-[(3-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43151448
1-[(3-fluoro-4-methoxybenzoyl)amino]cyclopentane-1-carboxylic acid
CID 43351057
1-[(5-methoxy-1-benzofuran-2-carbonyl)amino]cyclopentane-1-carboxylic acid
CID 46236390
1-[(4-chloro-2-methoxybenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158312
1-[(3-fluoro-4-methoxybenzoyl)amino]cycloheptane-1-carboxylic acid
CID 120538673
1-[(3-methoxy-4-methylbenzoyl)amino]cyclobutane-1-carboxylic acid
CID 81158397
N-(1-carbamothioylcyclopentyl)-2-fluoro-4-methoxybenzamide
CID 102883138
1-[2-(4-methoxy-2-methylphenyl)propanoylamino]cyclopentane-1-carboxylic acid
CID 22112040
3-[(2-hydroxy-5-methoxybenzoyl)amino]oxolane-3-carboxylic acid
CID 64889956

Frequently Asked Questions

What is the IUPAC name of 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid (CID 43351073) is 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid is COc1ccc(OC)c(C(=O)NC2(C(=O)O)CCCC2)c1.
What is the InChIKey of 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
The InChIKey is DBRGADOMOOHFHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO5/c1-20-10-5-6-12(21-2)11(9-10)13(17)16-15(14(18)19)7-3-4-8-15/h5-6,9H,3-4,7-8H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid?
1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid has a molecular weight of 293.32 g/mol, XLogP of 1.83, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,5-dimethoxybenzoyl)amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43351073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).