2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one

C17H13N3O — CID 58345682

IUPAC2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one
SMILESCc1nc2ccc(=O)[nH]c2n1-c1cccc2ccccc12
InChIInChI=1S/C17H13N3O/c1-11-18-14-9-10-16(21)19-17(14)20(11)15-8-4-6-12-5-2-3-7-13(12)15/h2-10H,1H3,(H,19,21)
InChIKeyHYICPSRRYNYBKI-UHFFFAOYSA-N
MW275.31 g/mol
LogP3.18
Rot. Bonds1

About 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one

2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one (PubChem CID 58345682) has the molecular formula C17H13N3O and a molecular weight of 275.31 g/mol. Its IUPAC name is 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one.

Molecular Properties

Compound Name2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one
PubChem CID58345682
Molecular FormulaC17H13N3O
Molecular Weight275.31 g/mol
Exact Mass275.11
IUPAC Name2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one
SMILESCc1nc2ccc(=O)[nH]c2n1-c1cccc2ccccc12
InChIInChI=1S/C17H13N3O/c1-11-18-14-9-10-16(21)19-17(14)20(11)15-8-4-6-12-5-2-3-7-13(12)15/h2-10H,1H3,(H,19,21)
InChIKeyHYICPSRRYNYBKI-UHFFFAOYSA-N
XLogP3.18
TPSA50.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.31
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one?
The IUPAC name of 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one (CID 58345682) is 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one.
What is the SMILES notation for 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one?
The canonical SMILES for 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one is Cc1nc2ccc(=O)[nH]c2n1-c1cccc2ccccc12.
What is the InChIKey of 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one?
The InChIKey is HYICPSRRYNYBKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13N3O/c1-11-18-14-9-10-16(21)19-17(14)20(11)15-8-4-6-12-5-2-3-7-13(12)15/h2-10H,1H3,(H,19,21).
What are the key properties of 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one?
2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one has a molecular weight of 275.31 g/mol, XLogP of 3.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-naphthalen-1-yl-4H-imidazo[4,5-b]pyridin-5-one is sourced from PubChem (CID 58345682), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).