2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide

C23H31N3O2 — CID 56538678

IUPAC2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide
SMILESCCN(CC)C(C(=O)N(C)CC(=O)Nc1cccc(C)c1C)c1ccccc1
InChIInChI=1S/C23H31N3O2/c1-6-26(7-2)22(19-13-9-8-10-14-19)23(28)25(5)16-21(27)24-20-15-11-12-17(3)18(20)4/h8-15,22H,6-7,16H2,1-5H3,(H,24,27)
InChIKeyNAENQRIDXWHJBY-UHFFFAOYSA-N
MW381.52 g/mol
LogP3.78
Rot. Bonds8

About 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide

2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide (PubChem CID 56538678) has the molecular formula C23H31N3O2 and a molecular weight of 381.52 g/mol. Its IUPAC name is 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide
PubChem CID56538678
Molecular FormulaC23H31N3O2
Molecular Weight381.52 g/mol
Exact Mass381.24
IUPAC Name2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide
SMILESCCN(CC)C(C(=O)N(C)CC(=O)Nc1cccc(C)c1C)c1ccccc1
InChIInChI=1S/C23H31N3O2/c1-6-26(7-2)22(19-13-9-8-10-14-19)23(28)25(5)16-21(27)24-20-15-11-12-17(3)18(20)4/h8-15,22H,6-7,16H2,1-5H3,(H,24,27)
InChIKeyNAENQRIDXWHJBY-UHFFFAOYSA-N
XLogP3.78
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(2-bromoanilino)-2-oxoethyl]-2-(diethylamino)-N-methyl-2-phenylacetamide
CID 56538781
3-amino-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N,2-dimethyl-3-phenylpropanamide
CID 119684102
2-amino-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3-phenylpropanamide
CID 119268365
2-amino-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylpropanamide;hydrochloride
CID 119268362
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methylbutanamide
CID 27807926
N-(2,3-dimethylphenyl)-2-[methyl-(2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl)amino]acetamide
CID 43021751
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-3-phenylsulfanylpropanamide
CID 27807987
N-(2,3-dimethylphenyl)-2-[methyl-[2-[methyl-[(1R)-1-phenylethyl]amino]-2-oxoethyl]amino]acetamide
CID 9348322
(2R)-N-benzyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]-N-ethylpropanamide
CID 9287521
N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N,3-dimethylbenzamide
CID 8503637
3-[acetyl(1-phenylethyl)amino]-N-(2,3-dimethylphenyl)propanamide
CID 113118985
2-[[(2S)-butan-2-yl]-(2-phenylsulfanylacetyl)amino]-N-(2,3-dimethylphenyl)acetamide
CID 7821075

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide?
The IUPAC name of 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide (CID 56538678) is 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide?
The canonical SMILES for 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide is CCN(CC)C(C(=O)N(C)CC(=O)Nc1cccc(C)c1C)c1ccccc1.
What is the InChIKey of 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide?
The InChIKey is NAENQRIDXWHJBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O2/c1-6-26(7-2)22(19-13-9-8-10-14-19)23(28)25(5)16-21(27)24-20-15-11-12-17(3)18(20)4/h8-15,22H,6-7,16H2,1-5H3,(H,24,27).
What are the key properties of 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide?
2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide has a molecular weight of 381.52 g/mol, XLogP of 3.78, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-[2-(2,3-dimethylanilino)-2-oxoethyl]-N-methyl-2-phenylacetamide is sourced from PubChem (CID 56538678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).