2-ethoxy-N-[(2-methylphenyl)methyl]acetamide

C12H17NO2 — CID 60646213

IUPAC2-ethoxy-N-[(2-methylphenyl)methyl]acetamide
SMILESCCOCC(=O)NCc1ccccc1C
InChIInChI=1S/C12H17NO2/c1-3-15-9-12(14)13-8-11-7-5-4-6-10(11)2/h4-7H,3,8-9H2,1-2H3,(H,13,14)
InChIKeyKQCQKQDXFNSVMP-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.65
Rot. Bonds5

About 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide

2-ethoxy-N-[(2-methylphenyl)methyl]acetamide (PubChem CID 60646213) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-ethoxy-N-[(2-methylphenyl)methyl]acetamide
PubChem CID60646213
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-ethoxy-N-[(2-methylphenyl)methyl]acetamide
SMILESCCOCC(=O)NCc1ccccc1C
InChIInChI=1S/C12H17NO2/c1-3-15-9-12(14)13-8-11-7-5-4-6-10(11)2/h4-7H,3,8-9H2,1-2H3,(H,13,14)
InChIKeyKQCQKQDXFNSVMP-UHFFFAOYSA-N
XLogP1.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-hydroxyethoxy)-N-[(2-methylphenyl)methyl]acetamide
CID 110678201
N-[(2-methylphenyl)methyl]-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604971
N-[[2-(diethylaminomethyl)phenyl]methyl]-2-ethoxyacetamide
CID 60676604
2-chloro-N-[(2-methylphenyl)methyl]acetamide
CID 9291148
2-ethoxy-N-[1-(2-methylphenyl)propan-2-yl]acetamide
CID 61063462
N-[(2-ethoxyphenyl)methyl]-2-(2-methylphenoxy)acetamide
CID 46778184
N-[(2-methylphenyl)methyl]-2-[(2-methylphenyl)methylamino]acetamide
CID 108996489
2-ethoxy-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 60668732
3,3-dimethyl-N-[(2-methylphenyl)methyl]butanamide
CID 110755430
[2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2,6-difluorobenzoate
CID 9203339
[2-[(2-bromophenyl)methylamino]-2-oxoethyl] 2-methylbenzoate
CID 46860420
cis-[2-[(2-methylphenyl)methylamino]-2-oxoethyl] (1R,2S)-2-methylcyclopropane-1-carboxylate
CID 9230512

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide?
The IUPAC name of 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide (CID 60646213) is 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide is CCOCC(=O)NCc1ccccc1C.
What is the InChIKey of 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide?
The InChIKey is KQCQKQDXFNSVMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c1-3-15-9-12(14)13-8-11-7-5-4-6-10(11)2/h4-7H,3,8-9H2,1-2H3,(H,13,14).
What are the key properties of 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide?
2-ethoxy-N-[(2-methylphenyl)methyl]acetamide has a molecular weight of 207.27 g/mol, XLogP of 1.65, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[(2-methylphenyl)methyl]acetamide is sourced from PubChem (CID 60646213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).