methyl 2-[(4-cyclopentylbenzoyl)amino]acetate

C15H19NO3 — CID 110487395

IUPACmethyl 2-[(4-cyclopentylbenzoyl)amino]acetate
SMILESCOC(=O)CNC(=O)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C15H19NO3/c1-19-14(17)10-16-15(18)13-8-6-12(7-9-13)11-4-2-3-5-11/h6-9,11H,2-5,10H2,1H3,(H,16,18)
InChIKeyCSFHTTXFCNSCDY-UHFFFAOYSA-N
MW261.32 g/mol
LogP2.25
Rot. Bonds4

About methyl 2-[(4-cyclopentylbenzoyl)amino]acetate

methyl 2-[(4-cyclopentylbenzoyl)amino]acetate (PubChem CID 110487395) has the molecular formula C15H19NO3 and a molecular weight of 261.32 g/mol. Its IUPAC name is methyl 2-[(4-cyclopentylbenzoyl)amino]acetate.

Molecular Properties

Compound Namemethyl 2-[(4-cyclopentylbenzoyl)amino]acetate
PubChem CID110487395
Molecular FormulaC15H19NO3
Molecular Weight261.32 g/mol
Exact Mass261.14
IUPAC Namemethyl 2-[(4-cyclopentylbenzoyl)amino]acetate
SMILESCOC(=O)CNC(=O)c1ccc(C2CCCC2)cc1
InChIInChI=1S/C15H19NO3/c1-19-14(17)10-16-15(18)13-8-6-12(7-9-13)11-4-2-3-5-11/h6-9,11H,2-5,10H2,1H3,(H,16,18)
InChIKeyCSFHTTXFCNSCDY-UHFFFAOYSA-N
XLogP2.25
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 52.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze methyl 2-[(4-cyclopentylbenzoyl)amino]acetate 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

ethyl 2-[(4-cyclohexylbenzoyl)amino]acetate
CID 60547206
2-[(4-cyclohexylbenzoyl)amino]acetic acid
CID 82485147
4-cyclohexyl-N-[2-oxo-2-(propylamino)ethyl]benzamide
CID 18162781
N-(2-amino-2-methylpropyl)-4-cyclohexylbenzamide;hydrochloride
CID 119625808
4-cyclohexyl-N-(2,2,2-trifluoroethyl)benzamide
CID 8900200
4-cyclohexyl-N'-methylbenzohydrazide
CID 116846851
4-cyclohexyl-N-[2-(ethylamino)ethyl]benzamide
CID 119504655
4-cyclohexyl-N-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]benzamide
CID 43021818
methyl 2-(4-cycloheptylphenyl)acetate
CID 54417181
4-cyclobutyl-N-propan-2-ylbenzamide
CID 174282086
methyl 2-[(4-cyclopentylbenzoyl)amino]propanoate
CID 110487402
N-(3-amino-2-methylpropyl)-4-cyclohexylbenzamide
CID 119995934

Frequently Asked Questions

What is the IUPAC name of methyl 2-[(4-cyclopentylbenzoyl)amino]acetate?
The IUPAC name of methyl 2-[(4-cyclopentylbenzoyl)amino]acetate (CID 110487395) is methyl 2-[(4-cyclopentylbenzoyl)amino]acetate.
What is the SMILES notation for methyl 2-[(4-cyclopentylbenzoyl)amino]acetate?
The canonical SMILES for methyl 2-[(4-cyclopentylbenzoyl)amino]acetate is COC(=O)CNC(=O)c1ccc(C2CCCC2)cc1.
What is the InChIKey of methyl 2-[(4-cyclopentylbenzoyl)amino]acetate?
The InChIKey is CSFHTTXFCNSCDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO3/c1-19-14(17)10-16-15(18)13-8-6-12(7-9-13)11-4-2-3-5-11/h6-9,11H,2-5,10H2,1H3,(H,16,18).
What are the key properties of methyl 2-[(4-cyclopentylbenzoyl)amino]acetate?
methyl 2-[(4-cyclopentylbenzoyl)amino]acetate has a molecular weight of 261.32 g/mol, XLogP of 2.25, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-[(4-cyclopentylbenzoyl)amino]acetate is sourced from PubChem (CID 110487395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).