ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate

C18H20N2O4 — CID 110178230

IUPACethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC(=O)c2ccccc2OCC)cc1
InChIInChI=1S/C18H20N2O4/c1-3-23-16-8-6-5-7-15(16)17(21)19-13-9-11-14(12-10-13)20-18(22)24-4-2/h5-12H,3-4H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyPVEYDEOHMPMTNG-UHFFFAOYSA-N
MW328.37 g/mol
LogP3.91
Rot. Bonds6

About ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate

ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate (PubChem CID 110178230) has the molecular formula C18H20N2O4 and a molecular weight of 328.37 g/mol. Its IUPAC name is ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate.

Molecular Properties

Compound Nameethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate
PubChem CID110178230
Molecular FormulaC18H20N2O4
Molecular Weight328.37 g/mol
Exact Mass328.14
IUPAC Nameethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate
SMILESCCOC(=O)Nc1ccc(NC(=O)c2ccccc2OCC)cc1
InChIInChI=1S/C18H20N2O4/c1-3-23-16-8-6-5-7-15(16)17(21)19-13-9-11-14(12-10-13)20-18(22)24-4-2/h5-12H,3-4H2,1-2H3,(H,19,21)(H,20,22)
InChIKeyPVEYDEOHMPMTNG-UHFFFAOYSA-N
XLogP3.91
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-ethoxy-N-(4-hydroxyphenyl)benzamide
CID 836714
2-ethoxy-N-[4-(propanoylamino)phenyl]benzamide
CID 17204882
2-ethoxy-N-(4-methoxyphenyl)benzamide
CID 5019237
propyl 4-[(2-ethoxybenzoyl)amino]benzoate
CID 4565616
N-(4-butan-2-ylphenyl)-2-ethoxybenzamide
CID 2852282
2-ethoxy-N-[4-(2-methylpropoxy)phenyl]benzamide
CID 4940660
2-ethoxy-N-[4-(2-ethoxyethoxy)phenyl]benzamide
CID 17130609
N-[4-[(2-ethoxybenzoyl)carbamothioylamino]phenyl]-2-methylbenzamide
CID 17251773
N-(4-amino-3-methoxyphenyl)-2-ethoxybenzamide
CID 61239481
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
N-[4-[[(2-ethoxybenzoyl)amino]carbamoyl]phenyl]benzamide
CID 4926581

Frequently Asked Questions

What is the IUPAC name of ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate?
The IUPAC name of ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate (CID 110178230) is ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate.
What is the SMILES notation for ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate?
The canonical SMILES for ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate is CCOC(=O)Nc1ccc(NC(=O)c2ccccc2OCC)cc1.
What is the InChIKey of ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate?
The InChIKey is PVEYDEOHMPMTNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O4/c1-3-23-16-8-6-5-7-15(16)17(21)19-13-9-11-14(12-10-13)20-18(22)24-4-2/h5-12H,3-4H2,1-2H3,(H,19,21)(H,20,22).
What are the key properties of ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate?
ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate has a molecular weight of 328.37 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[4-[(2-ethoxybenzoyl)amino]phenyl]carbamate is sourced from PubChem (CID 110178230), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).