N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide

C15H17N3O2S — CID 114956766

IUPACN-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide
SMILESCc1ccncc1CNS(=O)(=O)c1ccc2c(c1)NCC2
InChIInChI=1S/C15H17N3O2S/c1-11-4-6-16-9-13(11)10-18-21(19,20)14-3-2-12-5-7-17-15(12)8-14/h2-4,6,8-9,17-18H,5,7,10H2,1H3
InChIKeyDPERSNOBIWFDLW-UHFFFAOYSA-N
MW303.39 g/mol
LogP1.84
Rot. Bonds4

About N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide

N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide (PubChem CID 114956766) has the molecular formula C15H17N3O2S and a molecular weight of 303.39 g/mol. Its IUPAC name is N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide.

Molecular Properties

Compound NameN-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide
PubChem CID114956766
Molecular FormulaC15H17N3O2S
Molecular Weight303.39 g/mol
Exact Mass303.10
IUPAC NameN-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide
SMILESCc1ccncc1CNS(=O)(=O)c1ccc2c(c1)NCC2
InChIInChI=1S/C15H17N3O2S/c1-11-4-6-16-9-13(11)10-18-21(19,20)14-3-2-12-5-7-17-15(12)8-14/h2-4,6,8-9,17-18H,5,7,10H2,1H3
InChIKeyDPERSNOBIWFDLW-UHFFFAOYSA-N
XLogP1.84
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.39
LogP ≤ 51.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(methylamino)-N-[(4-methyl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 114957445
N-(5-methyl-3-pyridinyl)-2,3-dihydro-1H-indole-6-sulfonamide
CID 107585860
4-(2-aminoethyl)-N-[(4-methyl-3-pyridinyl)methyl]benzenesulfonamide
CID 114955251
5,6-dichloro-N-[(4-methyl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 114955310
6-cyano-N-[(4-methyl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 114956180
N-[2-(2-methylprop-2-enoxy)ethyl]-2,3-dihydro-1H-indole-6-sulfonamide
CID 114469007
N-(4,6-dimethyl-2-pyridinyl)-2,3-dihydro-1H-indole-6-sulfonamide
CID 114932717
4-(methylamino)-N-[(4-methyl-3-pyridinyl)methyl]pyridine-3-sulfonamide
CID 114957462
4-amino-2,6-dichloro-N-[(4-methyl-3-pyridinyl)methyl]benzenesulfonamide
CID 114954441
N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2,3-dihydro-1H-indole-5-sulfonamide
CID 106402227
N-[(4-methyl-3-pyridinyl)methyl]piperidine-3-sulfonamide
CID 114956767
N-(thian-2-ylmethyl)-2,3-dihydro-1H-indole-6-sulfonamide
CID 80600536

Frequently Asked Questions

What is the IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide?
The IUPAC name of N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide (CID 114956766) is N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide.
What is the SMILES notation for N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide?
The canonical SMILES for N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide is Cc1ccncc1CNS(=O)(=O)c1ccc2c(c1)NCC2.
What is the InChIKey of N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide?
The InChIKey is DPERSNOBIWFDLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O2S/c1-11-4-6-16-9-13(11)10-18-21(19,20)14-3-2-12-5-7-17-15(12)8-14/h2-4,6,8-9,17-18H,5,7,10H2,1H3.
What are the key properties of N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide?
N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide has a molecular weight of 303.39 g/mol, XLogP of 1.84, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-methyl-3-pyridinyl)methyl]-2,3-dihydro-1H-indole-6-sulfonamide is sourced from PubChem (CID 114956766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).