(3-chlorophenyl)methanesulfonamide

C7H8ClNO2S — CID 11469803

IUPAC(3-chlorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C7H8ClNO2S/c8-7-3-1-2-6(4-7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11)
InChIKeyHNZCHWOSESAIJA-UHFFFAOYSA-N
MW205.67 g/mol
LogP1.13
Rot. Bonds2

About (3-chlorophenyl)methanesulfonamide

(3-chlorophenyl)methanesulfonamide (PubChem CID 11469803) has the molecular formula C7H8ClNO2S and a molecular weight of 205.67 g/mol. Its IUPAC name is (3-chlorophenyl)methanesulfonamide.

Molecular Properties

Compound Name(3-chlorophenyl)methanesulfonamide
PubChem CID11469803
Molecular FormulaC7H8ClNO2S
Molecular Weight205.67 g/mol
Exact Mass205.00
IUPAC Name(3-chlorophenyl)methanesulfonamide
SMILESNS(=O)(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C7H8ClNO2S/c8-7-3-1-2-6(4-7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11)
InChIKeyHNZCHWOSESAIJA-UHFFFAOYSA-N
XLogP1.13
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.67
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Benzenemethanesulfonamide
CID 78318
p-Chlorobenzyl vinyl sulfone
CID 99234
(E)-2-(4-chlorophenyl)ethene-1-sulfonyl fluoride
CID 121553280
2-Chlorobenzylsulfonamide
CID 146065
(4-Chlorophenyl)methanesulfonyl chloride
CID 227304
(2-Chlorophenyl)methanesulfonyl chloride
CID 2757801
(3-Chlorophenyl)methanesulfonyl chloride
CID 2757802
2-(3-Chlorophenyl)ethynesulfonamide
CID 58371425
Sulfone, p-chlorobenzyl methyl
CID 6453790
2-(3-chlorophenyl)-6,7-dihydro-5H-1,4-dithiepine 1,1,4,4-tetraoxide
CID 9861375
2-(2-Chlorophenyl)ethane-1-sulfonyl chloride
CID 2757778
(2,6-Dichlorophenyl)methanesulfonyl chloride
CID 594465

Frequently Asked Questions

What is the IUPAC name of (3-chlorophenyl)methanesulfonamide?
The IUPAC name of (3-chlorophenyl)methanesulfonamide (CID 11469803) is (3-chlorophenyl)methanesulfonamide.
What is the SMILES notation for (3-chlorophenyl)methanesulfonamide?
The canonical SMILES for (3-chlorophenyl)methanesulfonamide is NS(=O)(=O)Cc1cccc(Cl)c1.
What is the InChIKey of (3-chlorophenyl)methanesulfonamide?
The InChIKey is HNZCHWOSESAIJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClNO2S/c8-7-3-1-2-6(4-7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11).
What are the key properties of (3-chlorophenyl)methanesulfonamide?
(3-chlorophenyl)methanesulfonamide has a molecular weight of 205.67 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chlorophenyl)methanesulfonamide is sourced from PubChem (CID 11469803), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).