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

C9H11N3O2 — CID 121199603

IUPAC3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESCOCCn1c(=O)[nH]c2cccnc21
InChIInChI=1S/C9H11N3O2/c1-14-6-5-12-8-7(11-9(12)13)3-2-4-10-8/h2-4H,5-6H2,1H3,(H,11,13)
InChIKeyNWGZGWMASLWGNZ-UHFFFAOYSA-N
MW193.21 g/mol
LogP0.37
Rot. Bonds3

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

3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one (PubChem CID 121199603) has the molecular formula C9H11N3O2 and a molecular weight of 193.21 g/mol. Its IUPAC name is 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one
PubChem CID121199603
Molecular FormulaC9H11N3O2
Molecular Weight193.21 g/mol
Exact Mass193.09
IUPAC Name3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one
SMILESCOCCn1c(=O)[nH]c2cccnc21
InChIInChI=1S/C9H11N3O2/c1-14-6-5-12-8-7(11-9(12)13)3-2-4-10-8/h2-4H,5-6H2,1H3,(H,11,13)
InChIKeyNWGZGWMASLWGNZ-UHFFFAOYSA-N
XLogP0.37
TPSA59.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.21
LogP ≤ 50.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one (CID 121199603) is 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one is COCCn1c(=O)[nH]c2cccnc21.
What is the InChIKey of 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is NWGZGWMASLWGNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2/c1-14-6-5-12-8-7(11-9(12)13)3-2-4-10-8/h2-4H,5-6H2,1H3,(H,11,13).
What are the key properties of 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one?
3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 193.21 g/mol, XLogP of 0.37, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethyl)-1H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 121199603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).