2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide

C15H14FNO3S — CID 1486368

IUPAC2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CS(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C15H14FNO3S/c1-20-13-6-4-12(5-7-13)17-15(18)10-21(19)14-8-2-11(16)3-9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyFOEXXOSQZHPYJW-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.58
Rot. Bonds5

About 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide

2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide (PubChem CID 1486368) has the molecular formula C15H14FNO3S and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide
PubChem CID1486368
Molecular FormulaC15H14FNO3S
Molecular Weight307.35 g/mol
Exact Mass307.07
IUPAC Name2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)CS(=O)c2ccc(F)cc2)cc1
InChIInChI=1S/C15H14FNO3S/c1-20-13-6-4-12(5-7-13)17-15(18)10-21(19)14-8-2-11(16)3-9-14/h2-9H,10H2,1H3,(H,17,18)
InChIKeyFOEXXOSQZHPYJW-UHFFFAOYSA-N
XLogP2.58
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(3-Methoxy-phenylsulfanyl)-phenyl]-butyramide
CID 15453821
7-Methoxy-1,4-benzothiazin-3(4H)-one
CID 403666
2-[(2-aminophenyl)sulfanyl]-N-(4-ethoxyphenyl)acetamide
CID 972877
2-[(3-chlorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
CID 1483400
2-[(4-fluorophenyl)sulfonyl]-N-(4-methoxyphenyl)acetamide
CID 1486369
2-[(2-chlorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
CID 1486373
2-[(2-chlorophenyl)sulfonyl]-N-(4-methoxyphenyl)acetamide
CID 1486374
[2-(4-Methoxyanilino)-2-oxoethyl] 3-phenylsulfanylpropanoate
CID 2380163
2-(benzylthio)-N-(4-methoxyphenyl)propanamide
CID 2889957
4-(4-Methoxyphenyl)-1-thia-4-azaspiro[4.5]decan-3-one
CID 753453
N-[4-(3-Methoxy-benzenesulfonyl)-phenyl]-butyramide
CID 9797715
N-(4-(4-(thiiran-2-ylmethylsulfonyl)phenoxy)phenyl)acetamide
CID 15941553

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide (CID 1486368) is 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)CS(=O)c2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide?
The InChIKey is FOEXXOSQZHPYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO3S/c1-20-13-6-4-12(5-7-13)17-15(18)10-21(19)14-8-2-11(16)3-9-14/h2-9H,10H2,1H3,(H,17,18).
What are the key properties of 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide?
2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide has a molecular weight of 307.35 g/mol, XLogP of 2.58, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluorophenyl)sulfinyl-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 1486368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).