8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one

C23H26N6O2 — CID 58379505

IUPAC8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCOc1ccc(-c2ccc3ncc4c(c3n2)n(CCN2CCCCC2)c(=O)n4C)cn1
InChIInChI=1S/C23H26N6O2/c1-27-19-15-24-18-8-7-17(16-6-9-20(31-2)25-14-16)26-21(18)22(19)29(23(27)30)13-12-28-10-4-3-5-11-28/h6-9,14-15H,3-5,10-13H2,1-2H3
InChIKeyLMICGVQXWJSHAC-UHFFFAOYSA-N
MW418.50 g/mol
LogP2.84
Rot. Bonds5

About 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one

8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one (PubChem CID 58379505) has the molecular formula C23H26N6O2 and a molecular weight of 418.50 g/mol. Its IUPAC name is 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one.

Molecular Properties

Compound Name8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one
PubChem CID58379505
Molecular FormulaC23H26N6O2
Molecular Weight418.50 g/mol
Exact Mass418.21
IUPAC Name8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one
SMILESCOc1ccc(-c2ccc3ncc4c(c3n2)n(CCN2CCCCC2)c(=O)n4C)cn1
InChIInChI=1S/C23H26N6O2/c1-27-19-15-24-18-8-7-17(16-6-9-20(31-2)25-14-16)26-21(18)22(19)29(23(27)30)13-12-28-10-4-3-5-11-28/h6-9,14-15H,3-5,10-13H2,1-2H3
InChIKeyLMICGVQXWJSHAC-UHFFFAOYSA-N
XLogP2.84
TPSA78.07 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.50
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The IUPAC name of 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one (CID 58379505) is 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one.
What is the SMILES notation for 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The canonical SMILES for 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one is COc1ccc(-c2ccc3ncc4c(c3n2)n(CCN2CCCCC2)c(=O)n4C)cn1.
What is the InChIKey of 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one?
The InChIKey is LMICGVQXWJSHAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N6O2/c1-27-19-15-24-18-8-7-17(16-6-9-20(31-2)25-14-16)26-21(18)22(19)29(23(27)30)13-12-28-10-4-3-5-11-28/h6-9,14-15H,3-5,10-13H2,1-2H3.
What are the key properties of 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one?
8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one has a molecular weight of 418.50 g/mol, XLogP of 2.84, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(6-methoxy-3-pyridinyl)-3-methyl-1-(2-piperidin-1-ylethyl)imidazo[4,5-c][1,5]naphthyridin-2-one is sourced from PubChem (CID 58379505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).