6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide

C14H11ClFN3O2S — CID 135191790

IUPAC6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
SMILESCc1cnc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)c1
InChIInChI=1S/C14H11ClFN3O2S/c1-8-4-11(16)14(18-6-8)19-22(20,21)13-7-17-12-5-9(15)2-3-10(12)13/h2-7,17H,1H3,(H,18,19)
InChIKeyQFNULVYGRQVIBI-UHFFFAOYSA-N
MW339.78 g/mol
LogP3.46
Rot. Bonds3

About 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide

6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide (PubChem CID 135191790) has the molecular formula C14H11ClFN3O2S and a molecular weight of 339.78 g/mol. Its IUPAC name is 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide.

Molecular Properties

Compound Name6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
PubChem CID135191790
Molecular FormulaC14H11ClFN3O2S
Molecular Weight339.78 g/mol
Exact Mass339.02
IUPAC Name6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide
SMILESCc1cnc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)c1
InChIInChI=1S/C14H11ClFN3O2S/c1-8-4-11(16)14(18-6-8)19-22(20,21)13-7-17-12-5-9(15)2-3-10(12)13/h2-7,17H,1H3,(H,18,19)
InChIKeyQFNULVYGRQVIBI-UHFFFAOYSA-N
XLogP3.46
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.78
LogP ≤ 53.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The IUPAC name of 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide (CID 135191790) is 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide.
What is the SMILES notation for 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The canonical SMILES for 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide is Cc1cnc(NS(=O)(=O)c2c[nH]c3cc(Cl)ccc23)c(F)c1.
What is the InChIKey of 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
The InChIKey is QFNULVYGRQVIBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11ClFN3O2S/c1-8-4-11(16)14(18-6-8)19-22(20,21)13-7-17-12-5-9(15)2-3-10(12)13/h2-7,17H,1H3,(H,18,19).
What are the key properties of 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide?
6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide has a molecular weight of 339.78 g/mol, XLogP of 3.46, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-fluoro-5-methyl-2-pyridinyl)-1H-indole-3-sulfonamide is sourced from PubChem (CID 135191790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).