N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide

C13H12FNO2S2 — CID 110440540

IUPACN-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NC1(c2ccc(F)cc2)CC1)c1cccs1
InChIInChI=1S/C13H12FNO2S2/c14-11-5-3-10(4-6-11)13(7-8-13)15-19(16,17)12-2-1-9-18-12/h1-6,9,15H,7-8H2
InChIKeyQBKGXRBPFGTORG-UHFFFAOYSA-N
MW297.38 g/mol
LogP2.85
Rot. Bonds4

About N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide

N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide (PubChem CID 110440540) has the molecular formula C13H12FNO2S2 and a molecular weight of 297.38 g/mol. Its IUPAC name is N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide
PubChem CID110440540
Molecular FormulaC13H12FNO2S2
Molecular Weight297.38 g/mol
Exact Mass297.03
IUPAC NameN-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide
SMILESO=S(=O)(NC1(c2ccc(F)cc2)CC1)c1cccs1
InChIInChI=1S/C13H12FNO2S2/c14-11-5-3-10(4-6-11)13(7-8-13)15-19(16,17)12-2-1-9-18-12/h1-6,9,15H,7-8H2
InChIKeyQBKGXRBPFGTORG-UHFFFAOYSA-N
XLogP2.85
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.38
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide
CID 16674138
4-fluoro-N-(1-phenylcyclopropyl)benzenesulfonamide
CID 110446070
N-(1-methylcyclopropyl)thiophene-2-sulfonamide
CID 130660498
N-[1-(3-chlorophenyl)cyclopentyl]thiophene-2-sulfonamide
CID 110440535
N-[1-(4-bromophenyl)cyclopropyl]-4-fluorobenzenesulfonamide
CID 52669958
N-fluorothiophene-2-sulfonamide
CID 175398216
N-[2-[(4-fluorophenyl)sulfonylamino]phenyl]thiophene-2-sulfonamide
CID 8505367
N-[3-[4-(4-fluorophenyl)piperazin-1-yl]propyl]thiophene-2-sulfonamide
CID 42389425
N-[4-fluoro-2-(thiophen-2-ylsulfonylamino)phenyl]thiophene-2-sulfonamide
CID 70133210
N-(1-cyanocycloheptyl)thiophene-2-sulfonamide
CID 61123105
N-[1-(4-fluorophenyl)cyclopropyl]-4-propan-2-yloxybenzenesulfonamide
CID 110446596
2,6-difluoro-N-(1-phenylcyclopropyl)benzenesulfonamide
CID 166183250

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide?
The IUPAC name of N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide (CID 110440540) is N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide?
The canonical SMILES for N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide is O=S(=O)(NC1(c2ccc(F)cc2)CC1)c1cccs1.
What is the InChIKey of N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide?
The InChIKey is QBKGXRBPFGTORG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO2S2/c14-11-5-3-10(4-6-11)13(7-8-13)15-19(16,17)12-2-1-9-18-12/h1-6,9,15H,7-8H2.
What are the key properties of N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide?
N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide has a molecular weight of 297.38 g/mol, XLogP of 2.85, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-fluorophenyl)cyclopropyl]thiophene-2-sulfonamide is sourced from PubChem (CID 110440540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).