2-cyclohexylsulfanyl-N-phenylacetamide

C14H19NOS — CID 23932731

IUPAC2-cyclohexylsulfanyl-N-phenylacetamide
SMILESO=C(CSC1CCCCC1)Nc1ccccc1
InChIInChI=1S/C14H19NOS/c16-14(15-12-7-3-1-4-8-12)11-17-13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,15,16)
InChIKeySFDYNPHJFRDILG-UHFFFAOYSA-N
MW249.38 g/mol
LogP3.69
Rot. Bonds4

About 2-cyclohexylsulfanyl-N-phenylacetamide

2-cyclohexylsulfanyl-N-phenylacetamide (PubChem CID 23932731) has the molecular formula C14H19NOS and a molecular weight of 249.38 g/mol. Its IUPAC name is 2-cyclohexylsulfanyl-N-phenylacetamide.

Molecular Properties

Compound Name2-cyclohexylsulfanyl-N-phenylacetamide
PubChem CID23932731
Molecular FormulaC14H19NOS
Molecular Weight249.38 g/mol
Exact Mass249.12
IUPAC Name2-cyclohexylsulfanyl-N-phenylacetamide
SMILESO=C(CSC1CCCCC1)Nc1ccccc1
InChIInChI=1S/C14H19NOS/c16-14(15-12-7-3-1-4-8-12)11-17-13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,15,16)
InChIKeySFDYNPHJFRDILG-UHFFFAOYSA-N
XLogP3.69
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.38
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide
CID 734043
N-phenyl-2-piperidin-3-ylsulfanylacetamide
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2-cyclohexylsulfanyl-N-(3-propan-2-ylphenyl)acetamide
CID 134042023
4-[(2-cyclohexylsulfanylacetyl)amino]-N,N-diethylbenzamide
CID 8705826
N-(2-aminophenyl)-2-cyclopentylsulfanylacetamide
CID 63114529
2-cyclohexylsulfanyl-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 8705717
2-cyclohexylsulfanyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 134042025
2-cyclopentylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 4821142
2-cyclopentylsulfanyl-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 8763703
N-(3-amino-4-chlorophenyl)-2-cyclopentylsulfanylacetamide
CID 62057025
2-cyclopropyl-N-phenylacetamide
CID 60753326
1-cyclopentylsulfanyl-3-phenylpropan-2-one
CID 63115475

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylsulfanyl-N-phenylacetamide?
The IUPAC name of 2-cyclohexylsulfanyl-N-phenylacetamide (CID 23932731) is 2-cyclohexylsulfanyl-N-phenylacetamide.
What is the SMILES notation for 2-cyclohexylsulfanyl-N-phenylacetamide?
The canonical SMILES for 2-cyclohexylsulfanyl-N-phenylacetamide is O=C(CSC1CCCCC1)Nc1ccccc1.
What is the InChIKey of 2-cyclohexylsulfanyl-N-phenylacetamide?
The InChIKey is SFDYNPHJFRDILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NOS/c16-14(15-12-7-3-1-4-8-12)11-17-13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2,(H,15,16).
What are the key properties of 2-cyclohexylsulfanyl-N-phenylacetamide?
2-cyclohexylsulfanyl-N-phenylacetamide has a molecular weight of 249.38 g/mol, XLogP of 3.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylsulfanyl-N-phenylacetamide is sourced from PubChem (CID 23932731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).