(3-chloro-2-fluorophenyl)methanesulfonamide

C7H7ClFNO2S — CID 112639862

IUPAC(3-chloro-2-fluorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cccc(Cl)c1F
InChIInChI=1S/C7H7ClFNO2S/c8-6-3-1-2-5(7(6)9)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12)
InChIKeyLOWZAWYOHMMCJL-UHFFFAOYSA-N
MW223.66 g/mol
LogP1.27
Rot. Bonds2

About (3-chloro-2-fluorophenyl)methanesulfonamide

(3-chloro-2-fluorophenyl)methanesulfonamide (PubChem CID 112639862) has the molecular formula C7H7ClFNO2S and a molecular weight of 223.66 g/mol. Its IUPAC name is (3-chloro-2-fluorophenyl)methanesulfonamide.

Molecular Properties

Compound Name(3-chloro-2-fluorophenyl)methanesulfonamide
PubChem CID112639862
Molecular FormulaC7H7ClFNO2S
Molecular Weight223.66 g/mol
Exact Mass222.99
IUPAC Name(3-chloro-2-fluorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cccc(Cl)c1F
InChIInChI=1S/C7H7ClFNO2S/c8-6-3-1-2-5(7(6)9)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12)
InChIKeyLOWZAWYOHMMCJL-UHFFFAOYSA-N
XLogP1.27
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 51.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Chloro-4-(trifluoromethyl)benzenesulfonamide
CID 2773925
(E)-2-(4-chlorophenyl)ethene-1-sulfonyl fluoride
CID 121553280
2-Chlorobenzylsulfonamide
CID 146065
(4-Chlorophenyl)methanesulfonyl chloride
CID 227304
(2-Fluorophenyl)methanesulfonamide
CID 22141435
(2-Chlorophenyl)methanesulfonyl chloride
CID 2757801
(3-Chlorophenyl)methanesulfonyl chloride
CID 2757802
2-(3-Chlorophenyl)ethynesulfonamide
CID 58371425
(3-Chlorophenyl)methanesulfonamide
CID 11469803
(2,6-Difluorophenyl)methanesulfonamide
CID 54476729
2-(4-Chlorophenyl)ethane-1-sulfonamide
CID 17803495
(1E)-2-(3-Chlorophenyl)ethenesulfonyl chloride
CID 22628233

Frequently Asked Questions

What is the IUPAC name of (3-chloro-2-fluorophenyl)methanesulfonamide?
The IUPAC name of (3-chloro-2-fluorophenyl)methanesulfonamide (CID 112639862) is (3-chloro-2-fluorophenyl)methanesulfonamide.
What is the SMILES notation for (3-chloro-2-fluorophenyl)methanesulfonamide?
The canonical SMILES for (3-chloro-2-fluorophenyl)methanesulfonamide is NS(=O)(=O)Cc1cccc(Cl)c1F.
What is the InChIKey of (3-chloro-2-fluorophenyl)methanesulfonamide?
The InChIKey is LOWZAWYOHMMCJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClFNO2S/c8-6-3-1-2-5(7(6)9)4-13(10,11)12/h1-3H,4H2,(H2,10,11,12).
What are the key properties of (3-chloro-2-fluorophenyl)methanesulfonamide?
(3-chloro-2-fluorophenyl)methanesulfonamide has a molecular weight of 223.66 g/mol, XLogP of 1.27, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-2-fluorophenyl)methanesulfonamide is sourced from PubChem (CID 112639862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).