[4-(ethylcarbamoyl)phenyl] formate

C10H11NO3 — CID 165120828

IUPAC[4-(ethylcarbamoyl)phenyl] formate
SMILESCCNC(=O)c1ccc(OC=O)cc1
InChIInChI=1S/C10H11NO3/c1-2-11-10(13)8-3-5-9(6-4-8)14-7-12/h3-7H,2H2,1H3,(H,11,13)
InChIKeyPSXDEGIPGXSPED-UHFFFAOYSA-N
MW193.20 g/mol
LogP0.97
Rot. Bonds4

About [4-(ethylcarbamoyl)phenyl] formate

[4-(ethylcarbamoyl)phenyl] formate (PubChem CID 165120828) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is [4-(ethylcarbamoyl)phenyl] formate.

Molecular Properties

Compound Name[4-(ethylcarbamoyl)phenyl] formate
PubChem CID165120828
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name[4-(ethylcarbamoyl)phenyl] formate
SMILESCCNC(=O)c1ccc(OC=O)cc1
InChIInChI=1S/C10H11NO3/c1-2-11-10(13)8-3-5-9(6-4-8)14-7-12/h3-7H,2H2,1H3,(H,11,13)
InChIKeyPSXDEGIPGXSPED-UHFFFAOYSA-N
XLogP0.97
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze [4-(ethylcarbamoyl)phenyl] formate 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

[4-(ethylcarbamoyl)phenoxy]boronic acid
CID 142787457
N-ethyl-4-(2-methoxyethoxy)benzamide
CID 15943034
[4-(ethylcarbamoyl)phenyl] N-fluorocarbamate
CID 59335547
N-ethyl-4-[(4-methoxybenzoyl)amino]benzamide
CID 17234279
ethane;N-ethyl-4-hydroxybenzamide
CID 144926309
N-ethylbenzamide
CID 160772566
4-(cyclopropylmethoxy)-N-ethylbenzamide
CID 60572461
4-[2-(dimethylamino)ethoxy]-N-ethylbenzamide
CID 110465146
CID 153373554
CID 153373554
N-ethyl-4-trimethylstannylbenzamide
CID 163615316
[4-(ethylcarbamoyl)phenyl]carbamic acid;propane
CID 142227182
N-ethylbenzamide;hydrochloride
CID 57444995

Frequently Asked Questions

What is the IUPAC name of [4-(ethylcarbamoyl)phenyl] formate?
The IUPAC name of [4-(ethylcarbamoyl)phenyl] formate (CID 165120828) is [4-(ethylcarbamoyl)phenyl] formate.
What is the SMILES notation for [4-(ethylcarbamoyl)phenyl] formate?
The canonical SMILES for [4-(ethylcarbamoyl)phenyl] formate is CCNC(=O)c1ccc(OC=O)cc1.
What is the InChIKey of [4-(ethylcarbamoyl)phenyl] formate?
The InChIKey is PSXDEGIPGXSPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3/c1-2-11-10(13)8-3-5-9(6-4-8)14-7-12/h3-7H,2H2,1H3,(H,11,13).
What are the key properties of [4-(ethylcarbamoyl)phenyl] formate?
[4-(ethylcarbamoyl)phenyl] formate has a molecular weight of 193.20 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylcarbamoyl)phenyl] formate is sourced from PubChem (CID 165120828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).