ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate

C22H22N2O4 — CID 87043151

IUPACethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate
SMILESCCOC(=O)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1C
InChIInChI=1S/C22H22N2O4/c1-3-27-22(26)24-20-10-6-9-19(15(20)2)23-21(25)14-28-18-12-11-16-7-4-5-8-17(16)13-18/h4-13H,3,14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyHRRBFNQFJSAPJX-UHFFFAOYSA-N
MW378.43 g/mol
LogP4.73
Rot. Bonds6

About ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate

ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate (PubChem CID 87043151) has the molecular formula C22H22N2O4 and a molecular weight of 378.43 g/mol. Its IUPAC name is ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate.

Molecular Properties

Compound Nameethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate
PubChem CID87043151
Molecular FormulaC22H22N2O4
Molecular Weight378.43 g/mol
Exact Mass378.16
IUPAC Nameethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate
SMILESCCOC(=O)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1C
InChIInChI=1S/C22H22N2O4/c1-3-27-22(26)24-20-10-6-9-19(15(20)2)23-21(25)14-28-18-12-11-16-7-4-5-8-17(16)13-18/h4-13H,3,14H2,1-2H3,(H,23,25)(H,24,26)
InChIKeyHRRBFNQFJSAPJX-UHFFFAOYSA-N
XLogP4.73
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.43
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate 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

N-(2-aminophenyl)-2-naphthalen-2-yloxyacetamide
CID 16792527
N-(2-hydroxy-4-methylphenyl)-2-naphthalen-2-yloxyacetamide
CID 2688141
N-(2-methylsulfanylphenyl)-2-naphthalen-2-yloxyacetamide
CID 4805358
N-(3-acetamido-2-methylphenyl)-2-(4-ethoxyphenoxy)acetamide
CID 134019141
[2-(2-methylanilino)-2-oxoethyl] 2-naphthalen-2-yloxyacetate
CID 7843327
N-(2-chloro-5-methylphenyl)-2-naphthalen-2-yloxyacetamide
CID 112811882
N-(3-chloro-2-fluorophenyl)-2-naphthalen-2-yloxyacetamide
CID 26309229
N-(2-chloro-4-methylphenyl)-2-naphthalen-2-yloxyacetamide
CID 7926753
ethyl N-[3-[2-(2-ethylanilino)-2-oxoethoxy]phenyl]carbamate
CID 30011225
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]-2-methylphenyl]propanamide
CID 38300469
N-[2-methyl-3-[(2-phenoxyacetyl)amino]phenyl]propanamide
CID 38300689
N-[3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]propanamide
CID 807123

Frequently Asked Questions

What is the IUPAC name of ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate?
The IUPAC name of ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate (CID 87043151) is ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate.
What is the SMILES notation for ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate?
The canonical SMILES for ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate is CCOC(=O)Nc1cccc(NC(=O)COc2ccc3ccccc3c2)c1C.
What is the InChIKey of ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate?
The InChIKey is HRRBFNQFJSAPJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4/c1-3-27-22(26)24-20-10-6-9-19(15(20)2)23-21(25)14-28-18-12-11-16-7-4-5-8-17(16)13-18/h4-13H,3,14H2,1-2H3,(H,23,25)(H,24,26).
What are the key properties of ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate?
ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate has a molecular weight of 378.43 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-[2-methyl-3-[(2-naphthalen-2-yloxyacetyl)amino]phenyl]carbamate is sourced from PubChem (CID 87043151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).