3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one

C19H20N6O2 — CID 58379640

IUPAC3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCn1cc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1
InChIInChI=1S/C19H20N6O2/c1-23-11-12(9-21-23)14-3-4-15-17(22-14)18-16(10-20-15)24(2)19(26)25(18)13-5-7-27-8-6-13/h3-4,9-11,13H,5-8H2,1-2H3
InChIKeyZLGGEHMGVUVIHP-UHFFFAOYSA-N
MW364.41 g/mol
LogP2.04
Rot. Bonds2

About 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one

3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one (PubChem CID 58379640) has the molecular formula C19H20N6O2 and a molecular weight of 364.41 g/mol. Its IUPAC name is 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one.

Molecular Properties

Compound Name3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one
PubChem CID58379640
Molecular FormulaC19H20N6O2
Molecular Weight364.41 g/mol
Exact Mass364.16
IUPAC Name3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCn1cc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1
InChIInChI=1S/C19H20N6O2/c1-23-11-12(9-21-23)14-3-4-15-17(22-14)18-16(10-20-15)24(2)19(26)25(18)13-5-7-27-8-6-13/h3-4,9-11,13H,5-8H2,1-2H3
InChIKeyZLGGEHMGVUVIHP-UHFFFAOYSA-N
XLogP2.04
TPSA79.76 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.41
LogP ≤ 52.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The IUPAC name of 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one (CID 58379640) is 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one.
What is the SMILES notation for 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The canonical SMILES for 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one is Cn1cc(-c2ccc3ncc4c(c3n2)n(C2CCOCC2)c(=O)n4C)cn1.
What is the InChIKey of 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The InChIKey is ZLGGEHMGVUVIHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6O2/c1-23-11-12(9-21-23)14-3-4-15-17(22-14)18-16(10-20-15)24(2)19(26)25(18)13-5-7-27-8-6-13/h3-4,9-11,13H,5-8H2,1-2H3.
What are the key properties of 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one?
3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one has a molecular weight of 364.41 g/mol, XLogP of 2.04, 2 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-8-(1-methylpyrazol-4-yl)-1-(oxan-4-yl)imidazo[4,5-c][1,5]naphthyridin-2-one is sourced from PubChem (CID 58379640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).