4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one

C23H24N6O2 — CID 145271415

IUPAC4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one
SMILESCN1CCCC(n2c(=O)n(-c3ccc(Oc4ccccn4)cc3)c3c(N)nccc32)C1
InChIInChI=1S/C23H24N6O2/c1-27-14-4-5-17(15-27)28-19-11-13-26-22(24)21(19)29(23(28)30)16-7-9-18(10-8-16)31-20-6-2-3-12-25-20/h2-3,6-13,17H,4-5,14-15H2,1H3,(H2,24,26)
InChIKeyXVXLCYQKKKPCDI-UHFFFAOYSA-N
MW416.49 g/mol
LogP3.22
Rot. Bonds4

About 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one

4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one (PubChem CID 145271415) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one.

Molecular Properties

Compound Name4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one
PubChem CID145271415
Molecular FormulaC23H24N6O2
Molecular Weight416.49 g/mol
Exact Mass416.20
IUPAC Name4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one
SMILESCN1CCCC(n2c(=O)n(-c3ccc(Oc4ccccn4)cc3)c3c(N)nccc32)C1
InChIInChI=1S/C23H24N6O2/c1-27-14-4-5-17(15-27)28-19-11-13-26-22(24)21(19)29(23(28)30)16-7-9-18(10-8-16)31-20-6-2-3-12-25-20/h2-3,6-13,17H,4-5,14-15H2,1H3,(H2,24,26)
InChIKeyXVXLCYQKKKPCDI-UHFFFAOYSA-N
XLogP3.22
TPSA91.20 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.49
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one?
The IUPAC name of 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one (CID 145271415) is 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one.
What is the SMILES notation for 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one?
The canonical SMILES for 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one is CN1CCCC(n2c(=O)n(-c3ccc(Oc4ccccn4)cc3)c3c(N)nccc32)C1.
What is the InChIKey of 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one?
The InChIKey is XVXLCYQKKKPCDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-27-14-4-5-17(15-27)28-19-11-13-26-22(24)21(19)29(23(28)30)16-7-9-18(10-8-16)31-20-6-2-3-12-25-20/h2-3,6-13,17H,4-5,14-15H2,1H3,(H2,24,26).
What are the key properties of 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one?
4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one has a molecular weight of 416.49 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(1-methylpiperidin-3-yl)-3-(4-pyridin-2-yloxyphenyl)imidazo[4,5-c]pyridin-2-one is sourced from PubChem (CID 145271415), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).