2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one

C7H7N3O — CID 58931349

IUPAC2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one
SMILESCc1nc2[nH]ccc(=O)c2[nH]1
InChIInChI=1S/C7H7N3O/c1-4-9-6-5(11)2-3-8-7(6)10-4/h2-3H,1H3,(H2,8,9,10,11)
InChIKeyWIUGDSWZMUKPMN-UHFFFAOYSA-N
MW149.15 g/mol
LogP0.56
Rot. Bonds

About 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one

2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one (PubChem CID 58931349) has the molecular formula C7H7N3O and a molecular weight of 149.15 g/mol. Its IUPAC name is 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one.

Molecular Properties

Compound Name2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one
PubChem CID58931349
Molecular FormulaC7H7N3O
Molecular Weight149.15 g/mol
Exact Mass149.06
IUPAC Name2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one
SMILESCc1nc2[nH]ccc(=O)c2[nH]1
InChIInChI=1S/C7H7N3O/c1-4-9-6-5(11)2-3-8-7(6)10-4/h2-3H,1H3,(H2,8,9,10,11)
InChIKeyWIUGDSWZMUKPMN-UHFFFAOYSA-N
XLogP0.56
TPSA61.54 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.15
LogP ≤ 50.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one?
The IUPAC name of 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one (CID 58931349) is 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one.
What is the SMILES notation for 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one?
The canonical SMILES for 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one is Cc1nc2[nH]ccc(=O)c2[nH]1.
What is the InChIKey of 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one?
The InChIKey is WIUGDSWZMUKPMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3O/c1-4-9-6-5(11)2-3-8-7(6)10-4/h2-3H,1H3,(H2,8,9,10,11).
What are the key properties of 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one?
2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one has a molecular weight of 149.15 g/mol, XLogP of 0.56, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,4-dihydroimidazo[4,5-b]pyridin-7-one is sourced from PubChem (CID 58931349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).