2-phenyl-2-phenylsulfanylacetamide

C14H13NOS — CID 4627806

IUPAC2-phenyl-2-phenylsulfanylacetamide
SMILESNC(=O)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C14H13NOS/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1-10,13H,(H2,15,16)
InChIKeyVDZLYEWXIUYNSS-UHFFFAOYSA-N
MW243.33 g/mol
LogP3.01
Rot. Bonds4

About 2-phenyl-2-phenylsulfanylacetamide

2-phenyl-2-phenylsulfanylacetamide (PubChem CID 4627806) has the molecular formula C14H13NOS and a molecular weight of 243.33 g/mol. Its IUPAC name is 2-phenyl-2-phenylsulfanylacetamide.

Molecular Properties

Compound Name2-phenyl-2-phenylsulfanylacetamide
PubChem CID4627806
Molecular FormulaC14H13NOS
Molecular Weight243.33 g/mol
Exact Mass243.07
IUPAC Name2-phenyl-2-phenylsulfanylacetamide
SMILESNC(=O)C(Sc1ccccc1)c1ccccc1
InChIInChI=1S/C14H13NOS/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1-10,13H,(H2,15,16)
InChIKeyVDZLYEWXIUYNSS-UHFFFAOYSA-N
XLogP3.01
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-2-phenyl-2-(phenylsulfanyl)acetamide
CID 2886275
N-hydroxy-2-(2-phenylthien-3-yl)acetamide
CID 3786
N,N-diethyl-2-phenyl-2-(phenylsulfanyl)acetamide
CID 2889554
N-methyl-2-phenyl-2-phenylsulfanylacetamide
CID 2889858
Dibenzo(b,e)thiepin-11-carboxamide, 6,11-dihydro-
CID 39771
3-phenyl-N-[2-(phenylthio)ethyl]propanamide
CID 2205200
N-ethyl-2-phenyl-2-(phenylsulfanyl)acetamide
CID 4246167
N-butan-2-yl-2-phenyl-2-phenylsulfanylacetamide
CID 4518969
3-Benzenesulfonyl-N-hydroxy-3-phenyl-propionamide
CID 10756964
(2R)-2-[(4-tert-butylphenyl)methylsulfanyl]-2-phenylacetamide
CID 162649781
(2S)-2-[(4-tert-butylphenyl)methylsulfanyl]-2-phenylacetamide
CID 162657554
2-Phenyl-2-[[3-(trifluoromethyl)phenyl]methylsulfanyl]acetamide
CID 162659743

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-2-phenylsulfanylacetamide?
The IUPAC name of 2-phenyl-2-phenylsulfanylacetamide (CID 4627806) is 2-phenyl-2-phenylsulfanylacetamide.
What is the SMILES notation for 2-phenyl-2-phenylsulfanylacetamide?
The canonical SMILES for 2-phenyl-2-phenylsulfanylacetamide is NC(=O)C(Sc1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenyl-2-phenylsulfanylacetamide?
The InChIKey is VDZLYEWXIUYNSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13NOS/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1-10,13H,(H2,15,16).
What are the key properties of 2-phenyl-2-phenylsulfanylacetamide?
2-phenyl-2-phenylsulfanylacetamide has a molecular weight of 243.33 g/mol, XLogP of 3.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-2-phenylsulfanylacetamide is sourced from PubChem (CID 4627806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).