2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide

C15H14FNO3S — CID 71283163

IUPAC2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)C[S@@](=O)c2cccc(F)c2)cc1
InChIInChI=1S/C15H14FNO3S/c1-20-13-7-5-12(6-8-13)17-15(18)10-21(19)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18)/t21-/m1/s1
InChIKeyWKWHIGCHZNFZMA-OAQYLSRUSA-N
MW307.35 g/mol
LogP2.58
Rot. Bonds5

About 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide

2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide (PubChem CID 71283163) has the molecular formula C15H14FNO3S and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
PubChem CID71283163
Molecular FormulaC15H14FNO3S
Molecular Weight307.35 g/mol
Exact Mass307.07
IUPAC Name2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)C[S@@](=O)c2cccc(F)c2)cc1
InChIInChI=1S/C15H14FNO3S/c1-20-13-7-5-12(6-8-13)17-15(18)10-21(19)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18)/t21-/m1/s1
InChIKeyWKWHIGCHZNFZMA-OAQYLSRUSA-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

2-(4-fluorophenyl)sulfinyl-N-(3-methoxyphenyl)acetamide
CID 63793167
2-[(R)-(4-bromophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
CID 40525367
2-(3-fluorophenyl)-N-[4-(4-methoxyanilino)phenyl]acetamide
CID 112987540
3-(3-fluoroanilino)-N-(4-methoxyphenyl)propanamide
CID 109039637
2-[2-(2,4-difluoroanilino)-2-oxoethyl]sulfinyl-N-(4-methoxyphenyl)acetamide
CID 24792559
2-(3-chlorophenyl)sulfinyl-N-(4-fluorophenyl)acetamide
CID 71283134
2-[(S)-(2-chlorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide
CID 40512822
2-[2-(4-methoxyanilino)-2-oxoethyl]sulfinylacetic acid
CID 854402
(3-fluorophenyl)methyl-[2-[4-[(4-methoxyphenyl)carbamoyl]anilino]-2-oxoethyl]-methylazanium
CID 8961817
2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
N'-(4-methoxyphenyl)-N-phenylpropanediamide
CID 15154641
1-N-(3-fluorophenyl)-2-N-(4-methoxyphenyl)cyclopropane-1,2-dicarboxamide
CID 109143442

Frequently Asked Questions

What is the IUPAC name of 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide?
The IUPAC name of 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide (CID 71283163) is 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide?
The canonical SMILES for 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide is COc1ccc(NC(=O)C[S@@](=O)c2cccc(F)c2)cc1.
What is the InChIKey of 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide?
The InChIKey is WKWHIGCHZNFZMA-OAQYLSRUSA-N. The full InChI is InChI=1S/C15H14FNO3S/c1-20-13-7-5-12(6-8-13)17-15(18)10-21(19)14-4-2-3-11(16)9-14/h2-9H,10H2,1H3,(H,17,18)/t21-/m1/s1.
What are the key properties of 2-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide?
2-[(R)-(3-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-[(R)-(3-fluorophenyl)sulfinyl]-N-(4-methoxyphenyl)acetamide is sourced from PubChem (CID 71283163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).