N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide

C13H18N2O3 — CID 61216429

IUPACN-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1cc(NC(C)=O)ccc1C
InChIInChI=1S/C13H18N2O3/c1-4-18-8-13(17)15-12-7-11(14-10(3)16)6-5-9(12)2/h5-7H,4,8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyJIHXMSWYNZUNIN-UHFFFAOYSA-N
MW250.30 g/mol
LogP1.93
Rot. Bonds5

About N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide

N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide (PubChem CID 61216429) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide
PubChem CID61216429
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC NameN-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide
SMILESCCOCC(=O)Nc1cc(NC(C)=O)ccc1C
InChIInChI=1S/C13H18N2O3/c1-4-18-8-13(17)15-12-7-11(14-10(3)16)6-5-9(12)2/h5-7H,4,8H2,1-3H3,(H,14,16)(H,15,17)
InChIKeyJIHXMSWYNZUNIN-UHFFFAOYSA-N
XLogP1.93
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-acetamido-2-methylphenyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 115950028
N-(5-acetamido-2-methylphenyl)-3-methylbutanamide
CID 47191002
N-[3-[[2-(4-ethoxyphenoxy)acetyl]amino]-4-methylphenyl]propanamide
CID 46487344
N-[2-(5-acetamido-2-methylanilino)-2-oxoethyl]-4-ethoxybenzamide
CID 46463640
5-(5-acetamido-2-methylanilino)-3-methyl-5-oxopentanoic acid
CID 62964215
N-(3-acetamido-4-methylphenyl)-2-(4-chloro-3,5-dimethylphenoxy)acetamide
CID 54777100
N-[5-[[2-(3-acetamidoanilino)acetyl]amino]-2-methylphenyl]propanamide
CID 54831751
2-(4-acetamidophenoxy)-N-(5-chloro-2-methylphenyl)acetamide
CID 964612
N-(3-acetamido-4-methylphenyl)-2-(4-bromophenoxy)acetamide
CID 54777061
(2S,3S)-N-(5-acetamido-2-methylphenyl)-2-amino-3-methylpentanamide
CID 61154615
N-[3-[(2-bromoacetyl)amino]-4-methylphenyl]propanamide
CID 63680059
N-(5-acetamido-2-methylphenyl)-3-ethoxybenzamide
CID 108788826

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide?
The IUPAC name of N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide (CID 61216429) is N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide.
What is the SMILES notation for N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide?
The canonical SMILES for N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide is CCOCC(=O)Nc1cc(NC(C)=O)ccc1C.
What is the InChIKey of N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide?
The InChIKey is JIHXMSWYNZUNIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-4-18-8-13(17)15-12-7-11(14-10(3)16)6-5-9(12)2/h5-7H,4,8H2,1-3H3,(H,14,16)(H,15,17).
What are the key properties of N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide?
N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide has a molecular weight of 250.30 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methylphenyl)-2-ethoxyacetamide is sourced from PubChem (CID 61216429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).