ethyl 2-(cyclopentylcarbamoylamino)benzoate

C15H20N2O3 — CID 110755189

IUPACethyl 2-(cyclopentylcarbamoylamino)benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)NC1CCCC1
InChIInChI=1S/C15H20N2O3/c1-2-20-14(18)12-9-5-6-10-13(12)17-15(19)16-11-7-3-4-8-11/h5-6,9-11H,2-4,7-8H2,1H3,(H2,16,17,19)
InChIKeyKNIRUZYUPRVYSQ-UHFFFAOYSA-N
MW276.34 g/mol
LogP2.93
Rot. Bonds4

About ethyl 2-(cyclopentylcarbamoylamino)benzoate

ethyl 2-(cyclopentylcarbamoylamino)benzoate (PubChem CID 110755189) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is ethyl 2-(cyclopentylcarbamoylamino)benzoate.

Molecular Properties

Compound Nameethyl 2-(cyclopentylcarbamoylamino)benzoate
PubChem CID110755189
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Nameethyl 2-(cyclopentylcarbamoylamino)benzoate
SMILESCCOC(=O)c1ccccc1NC(=O)NC1CCCC1
InChIInChI=1S/C15H20N2O3/c1-2-20-14(18)12-9-5-6-10-13(12)17-15(19)16-11-7-3-4-8-11/h5-6,9-11H,2-4,7-8H2,1H3,(H2,16,17,19)
InChIKeyKNIRUZYUPRVYSQ-UHFFFAOYSA-N
XLogP2.93
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze ethyl 2-(cyclopentylcarbamoylamino)benzoate 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-(cycloheptylcarbamoylamino)benzoate
CID 108990696
propyl 2-(cyclohexylcarbamoylamino)benzoate
CID 122389649
ethyl 2-[[2-(cyclohexylcarbamoylamino)acetyl]amino]benzoate
CID 113001757
ethyl 2-(2,3-dihydro-1H-inden-2-ylcarbamoylamino)benzoate
CID 3679782
ethyl 3-(cyclooctylcarbamothioylamino)-2-methylbenzoate
CID 100663642
ethyl 2-[[2-(cyclopentylcarbamoyl)pyridine-4-carbonyl]amino]benzoate
CID 109081013
ethyl 2-(cyclopropylamino)benzoate
CID 103438878
ethyl 3-(cyclohexylcarbamoylamino)-4-methylbenzoate
CID 100744542
methyl 2-[(1-ethylpiperidin-4-yl)carbamoylamino]benzoate
CID 6465197
ethyl 2-[[2-(cyclohexylamino)pyrimidine-5-carbonyl]amino]benzoate
CID 109250634
ethyl 2-[[(2R)-piperidine-2-carbonyl]amino]benzoate
CID 104913687
ethyl 2-[[5-(cycloheptylcarbamoyl)-2-pyridinyl]amino]benzoate
CID 109161084

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(cyclopentylcarbamoylamino)benzoate?
The IUPAC name of ethyl 2-(cyclopentylcarbamoylamino)benzoate (CID 110755189) is ethyl 2-(cyclopentylcarbamoylamino)benzoate.
What is the SMILES notation for ethyl 2-(cyclopentylcarbamoylamino)benzoate?
The canonical SMILES for ethyl 2-(cyclopentylcarbamoylamino)benzoate is CCOC(=O)c1ccccc1NC(=O)NC1CCCC1.
What is the InChIKey of ethyl 2-(cyclopentylcarbamoylamino)benzoate?
The InChIKey is KNIRUZYUPRVYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O3/c1-2-20-14(18)12-9-5-6-10-13(12)17-15(19)16-11-7-3-4-8-11/h5-6,9-11H,2-4,7-8H2,1H3,(H2,16,17,19).
What are the key properties of ethyl 2-(cyclopentylcarbamoylamino)benzoate?
ethyl 2-(cyclopentylcarbamoylamino)benzoate has a molecular weight of 276.34 g/mol, XLogP of 2.93, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(cyclopentylcarbamoylamino)benzoate is sourced from PubChem (CID 110755189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).