3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide

C15H14ClNO2S — CID 2823472

IUPAC3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide
SMILESO=S(=O)(NC1Cc2ccccc2C1)c1cccc(Cl)c1
InChIInChI=1S/C15H14ClNO2S/c16-13-6-3-7-15(10-13)20(18,19)17-14-8-11-4-1-2-5-12(11)9-14/h1-7,10,14,17H,8-9H2
InChIKeyQTMBDNACOSWELJ-UHFFFAOYSA-N
MW307.80 g/mol
LogP2.79
Rot. Bonds3

About 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide

3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide (PubChem CID 2823472) has the molecular formula C15H14ClNO2S and a molecular weight of 307.80 g/mol. Its IUPAC name is 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide.

Molecular Properties

Compound Name3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide
PubChem CID2823472
Molecular FormulaC15H14ClNO2S
Molecular Weight307.80 g/mol
Exact Mass307.04
IUPAC Name3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide
SMILESO=S(=O)(NC1Cc2ccccc2C1)c1cccc(Cl)c1
InChIInChI=1S/C15H14ClNO2S/c16-13-6-3-7-15(10-13)20(18,19)17-14-8-11-4-1-2-5-12(11)9-14/h1-7,10,14,17H,8-9H2
InChIKeyQTMBDNACOSWELJ-UHFFFAOYSA-N
XLogP2.79
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.80
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-4-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide
CID 107854598
3-chloro-N-[(3R)-pyrrolidin-3-yl]benzenesulfonamide
CID 79685888
3-[4-[(3-chlorophenyl)sulfonylamino]-4,5-dihydro-3H-benzo[cd]indol-1-yl]propanoic acid
CID 14347851
3-chloro-N-(6-methoxy-3,4-dihydro-2H-chromen-3-yl)benzenesulfonamide
CID 53210040
3-[3-(2,3-dihydro-1H-inden-2-ylsulfamoyl)phenyl]prop-2-enoic acid
CID 67019548
3-chloro-N-(3-chlorophenyl)sulfonylbenzenesulfonamide
CID 18537457
N-(1-benzylpiperidin-4-yl)-3-chlorobenzenesulfonamide;hydrochloride
CID 18197766
3-chloro-N-piperidin-3-ylbenzenesulfonamide;hydrochloride
CID 119964195
7-[(3-chlorophenyl)sulfonylamino]-3-fluoro-N-hydroxy-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 56933017
N-(2-bromocyclopentyl)-3-chlorobenzenesulfonamide
CID 80661956
3-chlorobenzenesulfonohydrazide
CID 12924057
5-amino-2-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide
CID 107843564

Frequently Asked Questions

What is the IUPAC name of 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide?
The IUPAC name of 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide (CID 2823472) is 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide.
What is the SMILES notation for 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide?
The canonical SMILES for 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide is O=S(=O)(NC1Cc2ccccc2C1)c1cccc(Cl)c1.
What is the InChIKey of 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide?
The InChIKey is QTMBDNACOSWELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2S/c16-13-6-3-7-15(10-13)20(18,19)17-14-8-11-4-1-2-5-12(11)9-14/h1-7,10,14,17H,8-9H2.
What are the key properties of 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide?
3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide has a molecular weight of 307.80 g/mol, XLogP of 2.79, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-N-(2,3-dihydro-1H-inden-2-yl)benzenesulfonamide is sourced from PubChem (CID 2823472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).