2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide

C14H11ClFNO2S — CID 71283134

IUPAC2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CS(=O)c1cccc(Cl)c1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11ClFNO2S/c15-10-2-1-3-13(8-10)20(19)9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18)
InChIKeyKYESDMPAQPNZDL-UHFFFAOYSA-N
MW311.77 g/mol
LogP3.23
Rot. Bonds4

About 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide

2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide (PubChem CID 71283134) has the molecular formula C14H11ClFNO2S and a molecular weight of 311.77 g/mol. Its IUPAC name is 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
PubChem CID71283134
Molecular FormulaC14H11ClFNO2S
Molecular Weight311.77 g/mol
Exact Mass311.02
IUPAC Name2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
SMILESO=C(CS(=O)c1cccc(Cl)c1)Nc1ccc(F)cc1
InChIInChI=1S/C14H11ClFNO2S/c15-10-2-1-3-13(8-10)20(19)9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18)
InChIKeyKYESDMPAQPNZDL-UHFFFAOYSA-N
XLogP3.23
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.77
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)sulfinyl-N-[4-(trifluoromethyl)phenyl]acetamide
CID 71283389
2-(3-chlorophenyl)sulfinyl-N-(4-methylsulfonylphenyl)acetamide
CID 71283350
2-(3-chlorophenyl)sulfinyl-N-(3-cyanophenyl)acetamide
CID 64691051
N-(2-chlorophenyl)-2-[(S)-(3-chlorophenyl)sulfinyl]acetamide
CID 40520627
N-(2-amino-4-chlorophenyl)-2-(3-chlorophenyl)sulfinylacetamide
CID 62646858
2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
CID 71283163
2-(2-amino-6-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
CID 81185788
N-(2-amino-4-chlorophenyl)-2-(4-fluorophenyl)sulfinylacetamide
CID 61301818
2-(4-fluorophenyl)sulfinyl-N-(3-methoxyphenyl)acetamide
CID 63793167
N'-(3,5-dichlorophenyl)-N-(4-fluorophenyl)propanediamide
CID 108954855
2-[(3-chlorophenyl)methyl-methylamino]-N-(4-fluorophenyl)acetamide
CID 9251256
2-[(R)-(3-chlorophenyl)methylsulfinyl]-N-(3-fluorophenyl)acetamide
CID 95169102

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide (CID 71283134) is 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide is O=C(CS(=O)c1cccc(Cl)c1)Nc1ccc(F)cc1.
What is the InChIKey of 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide?
The InChIKey is KYESDMPAQPNZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFNO2S/c15-10-2-1-3-13(8-10)20(19)9-14(18)17-12-6-4-11(16)5-7-12/h1-8H,9H2,(H,17,18).
What are the key properties of 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide?
2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide has a molecular weight of 311.77 g/mol, XLogP of 3.23, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 71283134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).