6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide

C19H16N6O2S — CID 146322878

IUPAC6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide
SMILESCc1ccncc1-c1cc2cc(Nc3ccc(S(N)(=O)=O)cn3)ncc2cn1
InChIInChI=1S/C19H16N6O2S/c1-12-4-5-21-11-16(12)17-6-13-7-19(23-9-14(13)8-22-17)25-18-3-2-15(10-24-18)28(20,26)27/h2-11H,1H3,(H2,20,26,27)(H,23,24,25)
InChIKeyWNCOZXBQTVAOCR-UHFFFAOYSA-N
MW392.44 g/mol
LogP2.79
Rot. Bonds4

About 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide

6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide (PubChem CID 146322878) has the molecular formula C19H16N6O2S and a molecular weight of 392.44 g/mol. Its IUPAC name is 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide
PubChem CID146322878
Molecular FormulaC19H16N6O2S
Molecular Weight392.44 g/mol
Exact Mass392.11
IUPAC Name6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide
SMILESCc1ccncc1-c1cc2cc(Nc3ccc(S(N)(=O)=O)cn3)ncc2cn1
InChIInChI=1S/C19H16N6O2S/c1-12-4-5-21-11-16(12)17-6-13-7-19(23-9-14(13)8-22-17)25-18-3-2-15(10-24-18)28(20,26)27/h2-11H,1H3,(H2,20,26,27)(H,23,24,25)
InChIKeyWNCOZXBQTVAOCR-UHFFFAOYSA-N
XLogP2.79
TPSA123.75 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.44
LogP ≤ 52.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide?
The IUPAC name of 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide (CID 146322878) is 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide.
What is the SMILES notation for 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide?
The canonical SMILES for 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide is Cc1ccncc1-c1cc2cc(Nc3ccc(S(N)(=O)=O)cn3)ncc2cn1.
What is the InChIKey of 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide?
The InChIKey is WNCOZXBQTVAOCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N6O2S/c1-12-4-5-21-11-16(12)17-6-13-7-19(23-9-14(13)8-22-17)25-18-3-2-15(10-24-18)28(20,26)27/h2-11H,1H3,(H2,20,26,27)(H,23,24,25).
What are the key properties of 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide?
6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide has a molecular weight of 392.44 g/mol, XLogP of 2.79, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[6-(4-methyl-3-pyridinyl)-2,7-naphthyridin-3-yl]amino]pyridine-3-sulfonamide is sourced from PubChem (CID 146322878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).