2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one

C17H14N4O — CID 58345764

IUPAC2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one
SMILESCc1ccc2ccccc2c1-n1c(N)nc2ccc(=O)[nH]c21
InChIInChI=1S/C17H14N4O/c1-10-6-7-11-4-2-3-5-12(11)15(10)21-16-13(19-17(21)18)8-9-14(22)20-16/h2-9H,1H3,(H2,18,19)(H,20,22)
InChIKeyGGKGQZABRSPIRD-UHFFFAOYSA-N
MW290.33 g/mol
LogP2.76
Rot. Bonds1

About 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one

2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one (PubChem CID 58345764) has the molecular formula C17H14N4O and a molecular weight of 290.33 g/mol. Its IUPAC name is 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one.

Molecular Properties

Compound Name2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one
PubChem CID58345764
Molecular FormulaC17H14N4O
Molecular Weight290.33 g/mol
Exact Mass290.12
IUPAC Name2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one
SMILESCc1ccc2ccccc2c1-n1c(N)nc2ccc(=O)[nH]c21
InChIInChI=1S/C17H14N4O/c1-10-6-7-11-4-2-3-5-12(11)15(10)21-16-13(19-17(21)18)8-9-14(22)20-16/h2-9H,1H3,(H2,18,19)(H,20,22)
InChIKeyGGKGQZABRSPIRD-UHFFFAOYSA-N
XLogP2.76
TPSA76.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.33
LogP ≤ 52.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one?
The IUPAC name of 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one (CID 58345764) is 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one.
What is the SMILES notation for 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one?
The canonical SMILES for 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one is Cc1ccc2ccccc2c1-n1c(N)nc2ccc(=O)[nH]c21.
What is the InChIKey of 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one?
The InChIKey is GGKGQZABRSPIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N4O/c1-10-6-7-11-4-2-3-5-12(11)15(10)21-16-13(19-17(21)18)8-9-14(22)20-16/h2-9H,1H3,(H2,18,19)(H,20,22).
What are the key properties of 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one?
2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one has a molecular weight of 290.33 g/mol, XLogP of 2.76, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-(2-methylnaphthalen-1-yl)-4H-imidazo[4,5-b]pyridin-5-one is sourced from PubChem (CID 58345764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).