N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide

C19H17N3O2S — CID 113016628

IUPACN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCc3ccccc32)nc1)c1ccccc1
InChIInChI=1S/C19H17N3O2S/c23-25(24,17-7-2-1-3-8-17)21-16-10-11-19(20-14-16)22-13-12-15-6-4-5-9-18(15)22/h1-11,14,21H,12-13H2
InChIKeyUOHPSUCCUAGFNQ-UHFFFAOYSA-N
MW351.43 g/mol
LogP3.58
Rot. Bonds4

About N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide

N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide (PubChem CID 113016628) has the molecular formula C19H17N3O2S and a molecular weight of 351.43 g/mol. Its IUPAC name is N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide.

Molecular Properties

Compound NameN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide
PubChem CID113016628
Molecular FormulaC19H17N3O2S
Molecular Weight351.43 g/mol
Exact Mass351.10
IUPAC NameN-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(N2CCc3ccccc32)nc1)c1ccccc1
InChIInChI=1S/C19H17N3O2S/c23-25(24,17-7-2-1-3-8-17)21-16-10-11-19(20-14-16)22-13-12-15-6-4-5-9-18(15)22/h1-11,14,21H,12-13H2
InChIKeyUOHPSUCCUAGFNQ-UHFFFAOYSA-N
XLogP3.58
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-3,4-dimethylbenzenesulfonamide
CID 113016633
1-[5-(dimethylsulfamoylamino)-2-pyridinyl]-2,3-dihydroindole
CID 113016627
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-4-methoxy-3-methylbenzenesulfonamide
CID 113016641
N-[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]ethanesulfonamide
CID 113016723
[6-(3,4-dihydro-2H-quinolin-1-yl)-3-pyridinyl]hydrazine
CID 82055128
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]oxolane-2-carboxamide
CID 113016563
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]-3-phenoxypropanamide
CID 113016596
N-[6-(1,2,4-triazol-1-yl)-3-pyridinyl]benzenesulfonamide
CID 60732618
N-[6-(2,3-dihydroindol-1-yl)pyridazin-3-yl]-4-propan-2-ylbenzenesulfonamide
CID 113046101
3-chloro-N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzamide
CID 113016598
6-(2,3-dihydroindol-1-yl)pyridine-3-diazonium
CID 58798115
1-[5-(bromomethyl)-2-pyridinyl]-2,3-dihydroindole
CID 107079443

Frequently Asked Questions

What is the IUPAC name of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide?
The IUPAC name of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide (CID 113016628) is N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide.
What is the SMILES notation for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide?
The canonical SMILES for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide is O=S(=O)(Nc1ccc(N2CCc3ccccc32)nc1)c1ccccc1.
What is the InChIKey of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide?
The InChIKey is UOHPSUCCUAGFNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O2S/c23-25(24,17-7-2-1-3-8-17)21-16-10-11-19(20-14-16)22-13-12-15-6-4-5-9-18(15)22/h1-11,14,21H,12-13H2.
What are the key properties of N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide?
N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide has a molecular weight of 351.43 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(2,3-dihydroindol-1-yl)-3-pyridinyl]benzenesulfonamide is sourced from PubChem (CID 113016628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).