N-ethyl-2-phenyl-2-phenylsulfanylacetamide

C16H17NOS — CID 4246167

IUPACN-ethyl-2-phenyl-2-phenylsulfanylacetamide
SMILESCCNC(=O)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NOS/c1-2-17-16(18)15(13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H,17,18)
InChIKeyLZEXAXRBGRAXMT-UHFFFAOYSA-N
MW271.38 g/mol
LogP3.66
Rot. Bonds5

About N-ethyl-2-phenyl-2-phenylsulfanylacetamide

N-ethyl-2-phenyl-2-phenylsulfanylacetamide (PubChem CID 4246167) has the molecular formula C16H17NOS and a molecular weight of 271.38 g/mol. Its IUPAC name is N-ethyl-2-phenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound NameN-ethyl-2-phenyl-2-phenylsulfanylacetamide
PubChem CID4246167
Molecular FormulaC16H17NOS
Molecular Weight271.38 g/mol
Exact Mass271.10
IUPAC NameN-ethyl-2-phenyl-2-phenylsulfanylacetamide
SMILESCCNC(=O)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NOS/c1-2-17-16(18)15(13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H,17,18)
InChIKeyLZEXAXRBGRAXMT-UHFFFAOYSA-N
XLogP3.66
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.38
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-phenyl-2-phenylsulfanylacetamide?
The IUPAC name of N-ethyl-2-phenyl-2-phenylsulfanylacetamide (CID 4246167) is N-ethyl-2-phenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for N-ethyl-2-phenyl-2-phenylsulfanylacetamide?
The canonical SMILES for N-ethyl-2-phenyl-2-phenylsulfanylacetamide is CCNC(=O)C(Sc1ccccc1)c1ccccc1.
What is the InChIKey of N-ethyl-2-phenyl-2-phenylsulfanylacetamide?
The InChIKey is LZEXAXRBGRAXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NOS/c1-2-17-16(18)15(13-9-5-3-6-10-13)19-14-11-7-4-8-12-14/h3-12,15H,2H2,1H3,(H,17,18).
What are the key properties of N-ethyl-2-phenyl-2-phenylsulfanylacetamide?
N-ethyl-2-phenyl-2-phenylsulfanylacetamide has a molecular weight of 271.38 g/mol, XLogP of 3.66, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-phenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 4246167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).