6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide

C14H11N5O2S — CID 11449808

IUPAC6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide
SMILESN#Cc1c[nH]c2c(NS(=O)(=O)c3ccc(N)nc3)cccc12
InChIInChI=1S/C14H11N5O2S/c15-6-9-7-18-14-11(9)2-1-3-12(14)19-22(20,21)10-4-5-13(16)17-8-10/h1-5,7-8,18-19H,(H2,16,17)
InChIKeyNRODUBOCYDXPLP-UHFFFAOYSA-N
MW313.34 g/mol
LogP1.82
Rot. Bonds3

About 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide

6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide (PubChem CID 11449808) has the molecular formula C14H11N5O2S and a molecular weight of 313.34 g/mol. Its IUPAC name is 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide
PubChem CID11449808
Molecular FormulaC14H11N5O2S
Molecular Weight313.34 g/mol
Exact Mass313.06
IUPAC Name6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide
SMILESN#Cc1c[nH]c2c(NS(=O)(=O)c3ccc(N)nc3)cccc12
InChIInChI=1S/C14H11N5O2S/c15-6-9-7-18-14-11(9)2-1-3-12(14)19-22(20,21)10-4-5-13(16)17-8-10/h1-5,7-8,18-19H,(H2,16,17)
InChIKeyNRODUBOCYDXPLP-UHFFFAOYSA-N
XLogP1.82
TPSA124.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.34
LogP ≤ 51.82
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

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CID 66730809
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CID 66731160
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CID 66731186
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CID 66731405
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CID 66733361
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CID 66734552
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CID 66734740
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Frequently Asked Questions

What is the IUPAC name of 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide (CID 11449808) is 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide is N#Cc1c[nH]c2c(NS(=O)(=O)c3ccc(N)nc3)cccc12.
What is the InChIKey of 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide?
The InChIKey is NRODUBOCYDXPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N5O2S/c15-6-9-7-18-14-11(9)2-1-3-12(14)19-22(20,21)10-4-5-13(16)17-8-10/h1-5,7-8,18-19H,(H2,16,17).
What are the key properties of 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide?
6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide has a molecular weight of 313.34 g/mol, XLogP of 1.82, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-(3-cyano-1H-indol-7-yl)pyridine-3-sulfonamide is sourced from PubChem (CID 11449808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).