2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one

C11H10N4O — CID 96612175

IUPAC2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one
SMILESO=C1CNCc2[nH]c(-c3cccnc3)nc21
InChIInChI=1S/C11H10N4O/c16-9-6-13-5-8-10(9)15-11(14-8)7-2-1-3-12-4-7/h1-4,13H,5-6H2,(H,14,15)
InChIKeyXGNIXHFBOGFETK-UHFFFAOYSA-N
MW214.23 g/mol
LogP0.76
Rot. Bonds1

About 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one

2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one (PubChem CID 96612175) has the molecular formula C11H10N4O and a molecular weight of 214.23 g/mol. Its IUPAC name is 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one.

Molecular Properties

Compound Name2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one
PubChem CID96612175
Molecular FormulaC11H10N4O
Molecular Weight214.23 g/mol
Exact Mass214.09
IUPAC Name2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one
SMILESO=C1CNCc2[nH]c(-c3cccnc3)nc21
InChIInChI=1S/C11H10N4O/c16-9-6-13-5-8-10(9)15-11(14-8)7-2-1-3-12-4-7/h1-4,13H,5-6H2,(H,14,15)
InChIKeyXGNIXHFBOGFETK-UHFFFAOYSA-N
XLogP0.76
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.23
LogP ≤ 50.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one?
The IUPAC name of 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one (CID 96612175) is 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one.
What is the SMILES notation for 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one?
The canonical SMILES for 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one is O=C1CNCc2[nH]c(-c3cccnc3)nc21.
What is the InChIKey of 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one?
The InChIKey is XGNIXHFBOGFETK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4O/c16-9-6-13-5-8-10(9)15-11(14-8)7-2-1-3-12-4-7/h1-4,13H,5-6H2,(H,14,15).
What are the key properties of 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one?
2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one has a molecular weight of 214.23 g/mol, XLogP of 0.76, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-3-yl-3,4,5,6-tetrahydroimidazo[4,5-c]pyridin-7-one is sourced from PubChem (CID 96612175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).