2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide

C19H24N2OS — CID 56538563

IUPAC2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide
SMILESCCN(CC)C(C(=O)Nc1cccc(SC)c1)c1ccccc1
InChIInChI=1S/C19H24N2OS/c1-4-21(5-2)18(15-10-7-6-8-11-15)19(22)20-16-12-9-13-17(14-16)23-3/h6-14,18H,4-5H2,1-3H3,(H,20,22)
InChIKeyWETNOUJTBXNDLD-UHFFFAOYSA-N
MW328.48 g/mol
LogP4.43
Rot. Bonds7

About 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide

2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide (PubChem CID 56538563) has the molecular formula C19H24N2OS and a molecular weight of 328.48 g/mol. Its IUPAC name is 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide.

Molecular Properties

Compound Name2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide
PubChem CID56538563
Molecular FormulaC19H24N2OS
Molecular Weight328.48 g/mol
Exact Mass328.16
IUPAC Name2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide
SMILESCCN(CC)C(C(=O)Nc1cccc(SC)c1)c1ccccc1
InChIInChI=1S/C19H24N2OS/c1-4-21(5-2)18(15-10-7-6-8-11-15)19(22)20-16-12-9-13-17(14-16)23-3/h6-14,18H,4-5H2,1-3H3,(H,20,22)
InChIKeyWETNOUJTBXNDLD-UHFFFAOYSA-N
XLogP4.43
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.48
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-methoxy-N-(3-methylsulfanylphenyl)-2-phenylacetamide
CID 124616033
N-[3-(tert-butylsulfamoyl)phenyl]-2-(diethylamino)-2-phenylacetamide
CID 56538153
2-(diethylamino)-N-[3-(3,5-dimethylpyrazol-1-yl)phenyl]-2-phenylacetamide
CID 56580511
N-[3-(cyclopropylsulfamoyl)phenyl]-2-(diethylamino)-2-phenylacetamide
CID 56581574
2-(diethylamino)-N-[3-(5-methylpyrazol-1-yl)phenyl]-2-phenylacetamide
CID 56538997
1-(2,2-diphenylethyl)-3-(3-methylsulfanylphenyl)urea
CID 3807651
2-[[2-(2,6-difluoroanilino)-2-oxoethyl]-ethylamino]-N,2-diphenylacetamide
CID 112804241
2-(diethylamino)-N-[3-(4-methylpiperazin-1-yl)sulfonylphenyl]-2-phenylacetamide
CID 56540390
3-amino-4-(3-methylsulfanylanilino)-4-oxobutanoic acid
CID 64896435
(2S)-2-methylsulfanyl-N-(3-methylsulfanylphenyl)propanamide
CID 38886217
1-(2-hydroxy-1-phenylethyl)-3-(3-methylsulfanylphenyl)urea
CID 72688100
2-cyano-N-(3-methylsulfanylphenyl)butanamide
CID 55207141

Frequently Asked Questions

What is the IUPAC name of 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide?
The IUPAC name of 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide (CID 56538563) is 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide.
What is the SMILES notation for 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide?
The canonical SMILES for 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide is CCN(CC)C(C(=O)Nc1cccc(SC)c1)c1ccccc1.
What is the InChIKey of 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide?
The InChIKey is WETNOUJTBXNDLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2OS/c1-4-21(5-2)18(15-10-7-6-8-11-15)19(22)20-16-12-9-13-17(14-16)23-3/h6-14,18H,4-5H2,1-3H3,(H,20,22).
What are the key properties of 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide?
2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide has a molecular weight of 328.48 g/mol, XLogP of 4.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylamino)-N-(3-methylsulfanylphenyl)-2-phenylacetamide is sourced from PubChem (CID 56538563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).