1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide

C15H14Cl2N2O2S — CID 36943943

IUPAC1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)CCN2Cc1c(Cl)cccc1Cl
InChIInChI=1S/C15H14Cl2N2O2S/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-8-11(22(18,20)21)4-5-15(10)19/h1-5,8H,6-7,9H2,(H2,18,20,21)
InChIKeyNQLHNPHKCGIBIK-UHFFFAOYSA-N
MW357.26 g/mol
LogP3.20
Rot. Bonds3

About 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide

1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide (PubChem CID 36943943) has the molecular formula C15H14Cl2N2O2S and a molecular weight of 357.26 g/mol. Its IUPAC name is 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide.

Molecular Properties

Compound Name1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
PubChem CID36943943
Molecular FormulaC15H14Cl2N2O2S
Molecular Weight357.26 g/mol
Exact Mass356.02
IUPAC Name1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
SMILESNS(=O)(=O)c1ccc2c(c1)CCN2Cc1c(Cl)cccc1Cl
InChIInChI=1S/C15H14Cl2N2O2S/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-8-11(22(18,20)21)4-5-15(10)19/h1-5,8H,6-7,9H2,(H2,18,20,21)
InChIKeyNQLHNPHKCGIBIK-UHFFFAOYSA-N
XLogP3.20
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.26
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-phenylphenyl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 34913237
1-[(4-fluorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 71943822
1-[(2-bromophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 17398357
1-(1,3-benzodioxol-4-ylmethyl)-2,3-dihydroindole-5-sulfonamide
CID 75386054
1-[(2-methyl-3-nitrophenyl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 60505069
1-[(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 18124778
1-(3-aminopropyl)-2,3-dihydroindole-5-sulfonamide
CID 28917333
1-[(5-methyl-1,2-oxazol-3-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 34913690
1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindol-6-amine
CID 29080631
1-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 25382319
1-[(3-propan-2-yl-1,2,4-thiadiazol-5-yl)methyl]-2,3-dihydroindole-5-sulfonamide
CID 146138470
3-[(5-piperidin-1-ylsulfonyl-2,3-dihydroindol-1-yl)methyl]phenol
CID 75451922

Frequently Asked Questions

What is the IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide?
The IUPAC name of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide (CID 36943943) is 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide.
What is the SMILES notation for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide?
The canonical SMILES for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide is NS(=O)(=O)c1ccc2c(c1)CCN2Cc1c(Cl)cccc1Cl.
What is the InChIKey of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide?
The InChIKey is NQLHNPHKCGIBIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Cl2N2O2S/c16-13-2-1-3-14(17)12(13)9-19-7-6-10-8-11(22(18,20)21)4-5-15(10)19/h1-5,8H,6-7,9H2,(H2,18,20,21).
What are the key properties of 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide?
1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide has a molecular weight of 357.26 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,6-dichlorophenyl)methyl]-2,3-dihydroindole-5-sulfonamide is sourced from PubChem (CID 36943943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).