1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one

C25H23N5O2 — CID 58379546

IUPAC1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCn1c(=O)n(C2CCC(O)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21
InChIInChI=1S/C25H23N5O2/c1-29-22-14-27-21-11-10-20(16-12-15-4-2-3-5-19(15)26-13-16)28-23(21)24(22)30(25(29)32)17-6-8-18(31)9-7-17/h2-5,10-14,17-18,31H,6-9H2,1H3
InChIKeyLEDZNERMENQHCL-UHFFFAOYSA-N
MW425.49 g/mol
LogP3.97
Rot. Bonds2

About 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one

1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one (PubChem CID 58379546) has the molecular formula C25H23N5O2 and a molecular weight of 425.49 g/mol. Its IUPAC name is 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one.

Molecular Properties

Compound Name1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one
PubChem CID58379546
Molecular FormulaC25H23N5O2
Molecular Weight425.49 g/mol
Exact Mass425.19
IUPAC Name1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCn1c(=O)n(C2CCC(O)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21
InChIInChI=1S/C25H23N5O2/c1-29-22-14-27-21-11-10-20(16-12-15-4-2-3-5-19(15)26-13-16)28-23(21)24(22)30(25(29)32)17-6-8-18(31)9-7-17/h2-5,10-14,17-18,31H,6-9H2,1H3
InChIKeyLEDZNERMENQHCL-UHFFFAOYSA-N
XLogP3.97
TPSA85.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500425.49
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one?
The IUPAC name of 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one (CID 58379546) is 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one.
What is the SMILES notation for 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one?
The canonical SMILES for 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one is Cn1c(=O)n(C2CCC(O)CC2)c2c3nc(-c4cnc5ccccc5c4)ccc3ncc21.
What is the InChIKey of 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one?
The InChIKey is LEDZNERMENQHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N5O2/c1-29-22-14-27-21-11-10-20(16-12-15-4-2-3-5-19(15)26-13-16)28-23(21)24(22)30(25(29)32)17-6-8-18(31)9-7-17/h2-5,10-14,17-18,31H,6-9H2,1H3.
What are the key properties of 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one?
1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one has a molecular weight of 425.49 g/mol, XLogP of 3.97, 2 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxycyclohexyl)-3-methyl-8-quinolin-3-ylimidazo[4,5-c][1,5]naphthyridin-2-one is sourced from PubChem (CID 58379546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).