4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide

C24H22N6O3 — CID 167511428

IUPAC4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide
SMILESCNc1cc2ncc(-c3cc(NC(=O)c4nccc5c4OCCC5O)cnc3C)cc2cn1
InChIInChI=1S/C24H22N6O3/c1-13-18(14-7-15-11-29-21(25-2)9-19(15)28-10-14)8-16(12-27-13)30-24(32)22-23-17(3-5-26-22)20(31)4-6-33-23/h3,5,7-12,20,31H,4,6H2,1-2H3,(H,25,29)(H,30,32)
InChIKeyJLFCBUFOFUDBME-UHFFFAOYSA-N
MW442.48 g/mol
LogP3.51
Rot. Bonds4

About 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide

4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide (PubChem CID 167511428) has the molecular formula C24H22N6O3 and a molecular weight of 442.48 g/mol. Its IUPAC name is 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide.

Molecular Properties

Compound Name4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide
PubChem CID167511428
Molecular FormulaC24H22N6O3
Molecular Weight442.48 g/mol
Exact Mass442.18
IUPAC Name4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide
SMILESCNc1cc2ncc(-c3cc(NC(=O)c4nccc5c4OCCC5O)cnc3C)cc2cn1
InChIInChI=1S/C24H22N6O3/c1-13-18(14-7-15-11-29-21(25-2)9-19(15)28-10-14)8-16(12-27-13)30-24(32)22-23-17(3-5-26-22)20(31)4-6-33-23/h3,5,7-12,20,31H,4,6H2,1-2H3,(H,25,29)(H,30,32)
InChIKeyJLFCBUFOFUDBME-UHFFFAOYSA-N
XLogP3.51
TPSA122.15 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500442.48
LogP ≤ 53.51
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide?
The IUPAC name of 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide (CID 167511428) is 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide.
What is the SMILES notation for 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide?
The canonical SMILES for 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide is CNc1cc2ncc(-c3cc(NC(=O)c4nccc5c4OCCC5O)cnc3C)cc2cn1.
What is the InChIKey of 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide?
The InChIKey is JLFCBUFOFUDBME-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22N6O3/c1-13-18(14-7-15-11-29-21(25-2)9-19(15)28-10-14)8-16(12-27-13)30-24(32)22-23-17(3-5-26-22)20(31)4-6-33-23/h3,5,7-12,20,31H,4,6H2,1-2H3,(H,25,29)(H,30,32).
What are the key properties of 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide?
4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide has a molecular weight of 442.48 g/mol, XLogP of 3.51, 4 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-N-[6-methyl-5-[7-(methylamino)-1,6-naphthyridin-3-yl]-3-pyridinyl]-3,4-dihydro-2H-pyrano[2,3-c]pyridine-8-carboxamide is sourced from PubChem (CID 167511428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).