(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide

C22H21NOS — CID 884563

IUPAC(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide
SMILESCCN(C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H21NOS/c1-2-23(19-14-8-4-9-15-19)22(24)21(18-12-6-3-7-13-18)25-20-16-10-5-11-17-20/h3-17,21H,2H2,1H3/t21-/m1/s1
InChIKeyPTCSFJWTRUMHCU-OAQYLSRUSA-N
MW347.48 g/mol
LogP5.57
Rot. Bonds6

About (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide

(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide (PubChem CID 884563) has the molecular formula C22H21NOS and a molecular weight of 347.48 g/mol. Its IUPAC name is (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound Name(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide
PubChem CID884563
Molecular FormulaC22H21NOS
Molecular Weight347.48 g/mol
Exact Mass347.13
IUPAC Name(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide
SMILESCCN(C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccccc1
InChIInChI=1S/C22H21NOS/c1-2-23(19-14-8-4-9-15-19)22(24)21(18-12-6-3-7-13-18)25-20-16-10-5-11-17-20/h3-17,21H,2H2,1H3/t21-/m1/s1
InChIKeyPTCSFJWTRUMHCU-OAQYLSRUSA-N
XLogP5.57
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500347.48
LogP ≤ 55.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethyl-2-methylsulfanyl-N,2-diphenylacetamide
CID 101243744
(2R)-N-methyl-N,2-diphenyl-2-phenylsulfanylacetamide
CID 821073
N,N'-diethyl-N,N',2-triphenylpropanediamide
CID 3397142
2-phenyl-2-phenylsulfanyl-N,N-dipropylacetamide
CID 3702485
2-chloro-N-ethyl-N,2-diphenylacetamide
CID 43245479
N,N-bis(2-methylpropyl)-2-phenyl-2-phenylsulfanylacetamide
CID 5102974
N-methyl-2-phenyl-2-phenylsulfanyl-N-propan-2-ylacetamide
CID 78844000
(2S)-2-phenyl-2-phenylsulfanylacetate
CID 7345805
N,N-dicyclohexyl-2-phenyl-2-phenylsulfanylacetamide
CID 4055742
(2S)-N-ethyl-2-phenyl-2-phenylsulfanyl-N-(pyridin-4-ylmethyl)acetamide
CID 40635886
N-[2-(diethylamino)ethyl]-2-phenyl-2-phenylsulfanylacetamide
CID 112759820
N-ethyl-2,3-dihydroxy-N-phenylpropanamide
CID 11195148

Frequently Asked Questions

What is the IUPAC name of (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide?
The IUPAC name of (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide (CID 884563) is (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide?
The canonical SMILES for (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide is CCN(C(=O)[C@H](Sc1ccccc1)c1ccccc1)c1ccccc1.
What is the InChIKey of (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide?
The InChIKey is PTCSFJWTRUMHCU-OAQYLSRUSA-N. The full InChI is InChI=1S/C22H21NOS/c1-2-23(19-14-8-4-9-15-19)22(24)21(18-12-6-3-7-13-18)25-20-16-10-5-11-17-20/h3-17,21H,2H2,1H3/t21-/m1/s1.
What are the key properties of (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide?
(2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide has a molecular weight of 347.48 g/mol, XLogP of 5.57, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-ethyl-N,2-diphenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 884563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).