5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide

C14H15ClFNO3S2 — CID 71810668

IUPAC5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide
SMILESCOC(C)(CNS(=O)(=O)c1ccc(Cl)s1)c1ccccc1F
InChIInChI=1S/C14H15ClFNO3S2/c1-14(20-2,10-5-3-4-6-11(10)16)9-17-22(18,19)13-8-7-12(15)21-13/h3-8,17H,9H2,1-2H3
InChIKeyBSZJJEQWHWARIG-UHFFFAOYSA-N
MW363.86 g/mol
LogP3.38
Rot. Bonds6

About 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide

5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide (PubChem CID 71810668) has the molecular formula C14H15ClFNO3S2 and a molecular weight of 363.86 g/mol. Its IUPAC name is 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide
PubChem CID71810668
Molecular FormulaC14H15ClFNO3S2
Molecular Weight363.86 g/mol
Exact Mass363.02
IUPAC Name5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide
SMILESCOC(C)(CNS(=O)(=O)c1ccc(Cl)s1)c1ccccc1F
InChIInChI=1S/C14H15ClFNO3S2/c1-14(20-2,10-5-3-4-6-11(10)16)9-17-22(18,19)13-8-7-12(15)21-13/h3-8,17H,9H2,1-2H3
InChIKeyBSZJJEQWHWARIG-UHFFFAOYSA-N
XLogP3.38
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.86
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(3,3,3-trifluoro-2-hydroxy-2-phenylpropyl)thiophene-2-sulfonamide
CID 71781999
N-[2-(3-fluorophenyl)-2-methoxyethyl]-5-methylthiophene-2-sulfonamide
CID 73168429
[(S)-2-(5-chloro-2-thienyl)-2-methoxyethyl][(2,5-difluorophenyl)methylsulfonyl]amine
CID 100729745
1-(2-Chlorophenyl)-N-[2-methoxy-2-(thiophen-3-YL)ethyl]methanesulfonamide
CID 71804775
(R)-2-(4-biphenylyl)-1-(5-chloro-2-thienylsulfonylamino)-2-propanol
CID 96351497
(2-thienylsulfonyl)[(R)-2-methoxy-2-phenylbutyl]amine
CID 97428632
(5-ethyl-2-thienylsulfonyl)[(R)-2-(m-chlorophenyl)-2-methoxypropyl]amine
CID 97554053
(5-bromo-2-thienylsulfonyl)[(R)-2-(m-chlorophenyl)-2-methoxypropyl]amine
CID 97554074
[(R)-2-(o-chlorophenyl)-2-methoxyethyl](2-thienylsulfonyl)amine
CID 99698253
5-chloro-N-[(2S,3S)-1-(4-fluorophenyl)-1-hydroxy-3-methylpentan-2-yl]thiophene-2-sulfonamide
CID 66929955
5-chloro-N-[(1S,3S)-1-(4-fluorophenyl)-1-hydroxy-3-methylpentan-2-yl]thiophene-2-sulfonamide
CID 66929956
5-chloro-N-[(2S)-1-(4-fluorophenyl)-1-hydroxy-3-methylpentan-2-yl]thiophene-2-sulfonamide
CID 66929959

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide?
The IUPAC name of 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide (CID 71810668) is 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide.
What is the SMILES notation for 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide?
The canonical SMILES for 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide is COC(C)(CNS(=O)(=O)c1ccc(Cl)s1)c1ccccc1F.
What is the InChIKey of 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide?
The InChIKey is BSZJJEQWHWARIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClFNO3S2/c1-14(20-2,10-5-3-4-6-11(10)16)9-17-22(18,19)13-8-7-12(15)21-13/h3-8,17H,9H2,1-2H3.
What are the key properties of 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide?
5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide has a molecular weight of 363.86 g/mol, XLogP of 3.38, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-[2-(2-fluorophenyl)-2-methoxypropyl]thiophene-2-sulfonamide is sourced from PubChem (CID 71810668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).