3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one

C19H23N5O2 — CID 167754259

IUPAC3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one
SMILESCOc1ccc2ncc(CNCc3cc4c([nH]c3=O)CCN(C)C4)n2c1
InChIInChI=1S/C19H23N5O2/c1-23-6-5-17-14(11-23)7-13(19(25)22-17)8-20-9-15-10-21-18-4-3-16(26-2)12-24(15)18/h3-4,7,10,12,20H,5-6,8-9,11H2,1-2H3,(H,22,25)
InChIKeyDJPQWAJRCNZJHY-UHFFFAOYSA-N
MW353.43 g/mol
LogP1.31
Rot. Bonds5

About 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one

3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one (PubChem CID 167754259) has the molecular formula C19H23N5O2 and a molecular weight of 353.43 g/mol. Its IUPAC name is 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one.

Molecular Properties

Compound Name3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one
PubChem CID167754259
Molecular FormulaC19H23N5O2
Molecular Weight353.43 g/mol
Exact Mass353.19
IUPAC Name3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one
SMILESCOc1ccc2ncc(CNCc3cc4c([nH]c3=O)CCN(C)C4)n2c1
InChIInChI=1S/C19H23N5O2/c1-23-6-5-17-14(11-23)7-13(19(25)22-17)8-20-9-15-10-21-18-4-3-16(26-2)12-24(15)18/h3-4,7,10,12,20H,5-6,8-9,11H2,1-2H3,(H,22,25)
InChIKeyDJPQWAJRCNZJHY-UHFFFAOYSA-N
XLogP1.31
TPSA74.66 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.43
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one?
The IUPAC name of 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one (CID 167754259) is 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one.
What is the SMILES notation for 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one?
The canonical SMILES for 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one is COc1ccc2ncc(CNCc3cc4c([nH]c3=O)CCN(C)C4)n2c1.
What is the InChIKey of 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one?
The InChIKey is DJPQWAJRCNZJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O2/c1-23-6-5-17-14(11-23)7-13(19(25)22-17)8-20-9-15-10-21-18-4-3-16(26-2)12-24(15)18/h3-4,7,10,12,20H,5-6,8-9,11H2,1-2H3,(H,22,25).
What are the key properties of 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one?
3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one has a molecular weight of 353.43 g/mol, XLogP of 1.31, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(6-methoxyimidazo[1,2-a]pyridin-3-yl)methylamino]methyl]-6-methyl-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one is sourced from PubChem (CID 167754259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).