N-(3,4-dichlorophenyl)propane-2-sulfonamide

C9H11Cl2NO2S — CID 62999267

IUPACN-(3,4-dichlorophenyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C9H11Cl2NO2S/c1-6(2)15(13,14)12-7-3-4-8(10)9(11)5-7/h3-6,12H,1-2H3
InChIKeyRLZYFSGOOXACMN-UHFFFAOYSA-N
MW268.17 g/mol
LogP3.14
Rot. Bonds3

About N-(3,4-dichlorophenyl)propane-2-sulfonamide

N-(3,4-dichlorophenyl)propane-2-sulfonamide (PubChem CID 62999267) has the molecular formula C9H11Cl2NO2S and a molecular weight of 268.17 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)propane-2-sulfonamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)propane-2-sulfonamide
PubChem CID62999267
Molecular FormulaC9H11Cl2NO2S
Molecular Weight268.17 g/mol
Exact Mass266.99
IUPAC NameN-(3,4-dichlorophenyl)propane-2-sulfonamide
SMILESCC(C)S(=O)(=O)Nc1ccc(Cl)c(Cl)c1
InChIInChI=1S/C9H11Cl2NO2S/c1-6(2)15(13,14)12-7-3-4-8(10)9(11)5-7/h3-6,12H,1-2H3
InChIKeyRLZYFSGOOXACMN-UHFFFAOYSA-N
XLogP3.14
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.17
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-4-(propan-2-ylsulfonylamino)benzenesulfonyl chloride
CID 60858307
N-(3-chloro-4-propan-2-yloxyphenyl)propane-2-sulfonamide
CID 63000379
N-(4-chloro-3-nitrophenyl)propane-2-sulfonamide
CID 62999282
2-chloro-4-(propan-2-ylsulfonylamino)benzamide
CID 62997643
N-[2-chloro-5-(methanesulfonamido)phenyl]propane-2-sulfonamide
CID 62999677
N-(6-chloro-3-pyridinyl)propane-2-sulfonamide
CID 57157565
N-(6-bromo-5-chloro-3-pyridinyl)propane-2-sulfonamide
CID 166636744
N-(2,5-dichlorophenyl)propane-2-sulfonamide
CID 62999639
2,4,5-trichloro-N-(3,4-dichlorophenyl)benzenesulfonamide
CID 22773572
N-(2-bromo-4-pyridinyl)propane-2-sulfonamide
CID 130699381
N-(3-fluoro-4-hydroxyphenyl)propane-2-sulfonamide
CID 64781842
3-(1-aminoethyl)-N-(3,4-dichlorophenyl)benzenesulfonamide
CID 43104208

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)propane-2-sulfonamide?
The IUPAC name of N-(3,4-dichlorophenyl)propane-2-sulfonamide (CID 62999267) is N-(3,4-dichlorophenyl)propane-2-sulfonamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)propane-2-sulfonamide?
The canonical SMILES for N-(3,4-dichlorophenyl)propane-2-sulfonamide is CC(C)S(=O)(=O)Nc1ccc(Cl)c(Cl)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)propane-2-sulfonamide?
The InChIKey is RLZYFSGOOXACMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11Cl2NO2S/c1-6(2)15(13,14)12-7-3-4-8(10)9(11)5-7/h3-6,12H,1-2H3.
What are the key properties of N-(3,4-dichlorophenyl)propane-2-sulfonamide?
N-(3,4-dichlorophenyl)propane-2-sulfonamide has a molecular weight of 268.17 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)propane-2-sulfonamide is sourced from PubChem (CID 62999267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).