2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide

C16H24N2O2 — CID 62037275

IUPAC2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)CC(=O)c1cccc(C)c1
InChIInChI=1S/C16H24N2O2/c1-5-18(11-16(20)17-12(2)3)10-15(19)14-8-6-7-13(4)9-14/h6-9,12H,5,10-11H2,1-4H3,(H,17,20)
InChIKeyRGQUTHKOXIIJQD-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.02
Rot. Bonds7

About 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide

2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide (PubChem CID 62037275) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide.

Molecular Properties

Compound Name2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
PubChem CID62037275
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
SMILESCCN(CC(=O)NC(C)C)CC(=O)c1cccc(C)c1
InChIInChI=1S/C16H24N2O2/c1-5-18(11-16(20)17-12(2)3)10-15(19)14-8-6-7-13(4)9-14/h6-9,12H,5,10-11H2,1-4H3,(H,17,20)
InChIKeyRGQUTHKOXIIJQD-UHFFFAOYSA-N
XLogP2.02
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[methyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 62036179
2-[ethyl-[2-(4-iodophenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 60679964
2-[[2-[[(1R)-1-(3,4-dimethylphenyl)ethyl]amino]-2-oxoethyl]-ethylamino]-N-propan-2-ylacetamide
CID 8906855
N-methyl-2-[methyl-[2-(3-methylphenyl)-2-oxoethyl]amino]acetamide
CID 62051984
2-[butyl(2-hydroxyethyl)amino]-1-(3-methylphenyl)ethanone
CID 62052086
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-[3-(trifluoromethyl)phenyl]acetamide
CID 8906928
2-[[2-(3-methoxyphenyl)-2-oxoethyl]-methylamino]-N-propan-2-ylacetamide
CID 60681718
2-[ethyl-[2-[[(1S)-1-naphthalen-2-ylethyl]amino]-2-oxoethyl]amino]-N-propan-2-ylacetamide
CID 8906831
2-[3,3-dimethylbutan-2-yl(methyl)amino]-1-(3-methylphenyl)ethanone
CID 55010786
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(3-sulfamoylphenyl)acetamide
CID 39895252
2-[butan-2-yl(butyl)amino]-1-(3-methylphenyl)ethanone
CID 55005484
2-[ethyl-[2-oxo-2-(propan-2-ylamino)ethyl]amino]-N-(2-iodophenyl)acetamide
CID 8907392

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The IUPAC name of 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide (CID 62037275) is 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide.
What is the SMILES notation for 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The canonical SMILES for 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide is CCN(CC(=O)NC(C)C)CC(=O)c1cccc(C)c1.
What is the InChIKey of 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
The InChIKey is RGQUTHKOXIIJQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-5-18(11-16(20)17-12(2)3)10-15(19)14-8-6-7-13(4)9-14/h6-9,12H,5,10-11H2,1-4H3,(H,17,20).
What are the key properties of 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide?
2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide has a molecular weight of 276.38 g/mol, XLogP of 2.02, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[2-(3-methylphenyl)-2-oxoethyl]amino]-N-propan-2-ylacetamide is sourced from PubChem (CID 62037275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).