N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide

C17H19NOS — CID 101243744

IUPACN-ethyl-2-methylsulfanyl-N,2-diphenylacetamide
SMILESCCN(C(=O)C(SC)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NOS/c1-3-18(15-12-8-5-9-13-15)17(19)16(20-2)14-10-6-4-7-11-14/h4-13,16H,3H2,1-2H3
InChIKeyBBMFMLSBDRITOV-UHFFFAOYSA-N
MW285.41 g/mol
LogP4.14
Rot. Bonds5

About N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide

N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide (PubChem CID 101243744) has the molecular formula C17H19NOS and a molecular weight of 285.41 g/mol. Its IUPAC name is N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide.

Molecular Properties

Compound NameN-ethyl-2-methylsulfanyl-N,2-diphenylacetamide
PubChem CID101243744
Molecular FormulaC17H19NOS
Molecular Weight285.41 g/mol
Exact Mass285.12
IUPAC NameN-ethyl-2-methylsulfanyl-N,2-diphenylacetamide
SMILESCCN(C(=O)C(SC)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H19NOS/c1-3-18(15-12-8-5-9-13-15)17(19)16(20-2)14-10-6-4-7-11-14/h4-13,16H,3H2,1-2H3
InChIKeyBBMFMLSBDRITOV-UHFFFAOYSA-N
XLogP4.14
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.41
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide
CID 884563
N,N'-diethyl-N,N',2-triphenylpropanediamide
CID 3397142
2-chloro-N-ethyl-N,2-diphenylacetamide
CID 43245479
N-ethyl-2,3-dihydroxy-N-phenylpropanamide
CID 11195148
N-ethyl-2-hydroxy-2-(4-methylphenyl)-N-phenylacetamide
CID 82134297
3-amino-N-ethyl-N-(4-methylphenyl)-2-phenylpropanamide
CID 62876984
N-ethyl-N,2-diphenyl-2-pyridin-2-ylacetamide
CID 110373393
N-ethyl-2,2-dimethyl-N-phenylpropanamide
CID 4127582
N-ethyl-2-methyl-3-(methylamino)-N-phenylpropanamide
CID 79196237
(2S)-N-ethyl-2-phenoxy-N-phenylpropanamide
CID 670227
5-(N-ethylanilino)-4-methyl-5-oxopentanoic acid
CID 11492533
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide?
The IUPAC name of N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide (CID 101243744) is N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide.
What is the SMILES notation for N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide?
The canonical SMILES for N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide is CCN(C(=O)C(SC)c1ccccc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide?
The InChIKey is BBMFMLSBDRITOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NOS/c1-3-18(15-12-8-5-9-13-15)17(19)16(20-2)14-10-6-4-7-11-14/h4-13,16H,3H2,1-2H3.
What are the key properties of N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide?
N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide has a molecular weight of 285.41 g/mol, XLogP of 4.14, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide is sourced from PubChem (CID 101243744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).