2-(3-chlorophenyl)benzenesulfinamide

C12H10ClNOS — CID 155244785

IUPAC2-(3-chlorophenyl)benzenesulfinamide
SMILESNS(=O)c1ccccc1-c1cccc(Cl)c1
InChIInChI=1S/C12H10ClNOS/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)16(14)15/h1-8H,14H2
InChIKeyNDCQHYPUPJSFHG-UHFFFAOYSA-N
MW251.74 g/mol
LogP2.99
Rot. Bonds2

About 2-(3-chlorophenyl)benzenesulfinamide

2-(3-chlorophenyl)benzenesulfinamide (PubChem CID 155244785) has the molecular formula C12H10ClNOS and a molecular weight of 251.74 g/mol. Its IUPAC name is 2-(3-chlorophenyl)benzenesulfinamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)benzenesulfinamide
PubChem CID155244785
Molecular FormulaC12H10ClNOS
Molecular Weight251.74 g/mol
Exact Mass251.02
IUPAC Name2-(3-chlorophenyl)benzenesulfinamide
SMILESNS(=O)c1ccccc1-c1cccc(Cl)c1
InChIInChI=1S/C12H10ClNOS/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)16(14)15/h1-8H,14H2
InChIKeyNDCQHYPUPJSFHG-UHFFFAOYSA-N
XLogP2.99
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.74
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-chloro-3-(2-phenylphenyl)benzene
CID 69293962
2-chloro-1,3-bis(3-chlorophenyl)benzene
CID 54080795
1-chloro-3-[2-[2-(3-chlorophenyl)phenyl]sulfanylphenyl]benzene
CID 54176640
2-[2-(3-chlorophenyl)phenyl]-2-hydroxyacetamide
CID 58434122
1-(3-chlorophenyl)-2-(4-methylsulfonylphenyl)benzene
CID 23451389
2-[2-(3-chlorophenyl)phenyl]ethanamine;hydrochloride
CID 164885899
2-amino-3-(3-chlorophenyl)naphthalene-1,4-dione
CID 90646353
[2-(3-chlorophenyl)phenyl]-phenylmethanone
CID 174644263
1'-(3-chlorophenyl)-9,9'-spirobi[fluorene]
CID 130380122
3-(3-chlorophenyl)-2,6-difluoroaniline
CID 165455763
tricyclo[6.6.0.02,6]tetradeca-1,3,5,7,9,11,13-heptaene
CID 101119071
[2-[3-(3-chlorophenyl)phenyl]phenyl]boronic acid
CID 177272028

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)benzenesulfinamide?
The IUPAC name of 2-(3-chlorophenyl)benzenesulfinamide (CID 155244785) is 2-(3-chlorophenyl)benzenesulfinamide.
What is the SMILES notation for 2-(3-chlorophenyl)benzenesulfinamide?
The canonical SMILES for 2-(3-chlorophenyl)benzenesulfinamide is NS(=O)c1ccccc1-c1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)benzenesulfinamide?
The InChIKey is NDCQHYPUPJSFHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10ClNOS/c13-10-5-3-4-9(8-10)11-6-1-2-7-12(11)16(14)15/h1-8H,14H2.
What are the key properties of 2-(3-chlorophenyl)benzenesulfinamide?
2-(3-chlorophenyl)benzenesulfinamide has a molecular weight of 251.74 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)benzenesulfinamide is sourced from PubChem (CID 155244785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).