2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide

C14H18FNOS — CID 734043

IUPAC2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CSC1CCCCC1)Nc1ccc(F)cc1
InChIInChI=1S/C14H18FNOS/c15-11-6-8-12(9-7-11)16-14(17)10-18-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17)
InChIKeyDAVXZVFDHRDDLG-UHFFFAOYSA-N
MW267.37 g/mol
LogP3.83
Rot. Bonds4

About 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide

2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide (PubChem CID 734043) has the molecular formula C14H18FNOS and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide
PubChem CID734043
Molecular FormulaC14H18FNOS
Molecular Weight267.37 g/mol
Exact Mass267.11
IUPAC Name2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CSC1CCCCC1)Nc1ccc(F)cc1
InChIInChI=1S/C14H18FNOS/c15-11-6-8-12(9-7-11)16-14(17)10-18-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17)
InChIKeyDAVXZVFDHRDDLG-UHFFFAOYSA-N
XLogP3.83
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclohexylsulfanyl-N-phenylacetamide
CID 23932731
4-[(2-cyclohexylsulfanylacetyl)amino]-N,N-diethylbenzamide
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2-cyclopentylsulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 4821142
N-(3-amino-4-chlorophenyl)-2-cyclopentylsulfanylacetamide
CID 62057025
2-cyclopentylsulfanyl-N-[4-(2,5-dimethylphenyl)sulfanylphenyl]acetamide
CID 7825723
N-cyclopropyl-2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanylacetamide
CID 9165511
N-phenyl-2-piperidin-3-ylsulfanylacetamide
CID 84754956
N-(4-ethylphenyl)-2-piperidin-4-ylsulfanylacetamide
CID 82181207
2-cyclohexylsulfanyl-N-(3-propan-2-ylphenyl)acetamide
CID 134042023
N-(4-bromo-3-fluorophenyl)-2-piperidin-4-ylsulfanylacetamide
CID 114627698
2-[(2R,4aS,8aS)-3-oxo-2,4,4a,5,6,7,8,8a-octahydro-1H-quinoxalin-2-yl]-N-(4-fluorophenyl)acetamide
CID 6546718
2-(cyclooctylamino)-N-[2-(4-fluoroanilino)-2-oxoethyl]acetamide
CID 9265208

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide (CID 734043) is 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide is O=C(CSC1CCCCC1)Nc1ccc(F)cc1.
What is the InChIKey of 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide?
The InChIKey is DAVXZVFDHRDDLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNOS/c15-11-6-8-12(9-7-11)16-14(17)10-18-13-4-2-1-3-5-13/h6-9,13H,1-5,10H2,(H,16,17).
What are the key properties of 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide?
2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide has a molecular weight of 267.37 g/mol, XLogP of 3.83, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexylsulfanyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 734043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).