3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine

C12H11N5O — CID 174278837

IUPAC3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
SMILESCOn1c(-c2cccnc2N)nc2cccnc21
InChIInChI=1S/C12H11N5O/c1-18-17-11(8-4-2-6-14-10(8)13)16-9-5-3-7-15-12(9)17/h2-7H,1H3,(H2,13,14)
InChIKeyBRMJLHNHLZWFMZ-UHFFFAOYSA-N
MW241.25 g/mol
LogP1.13
Rot. Bonds2

About 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine

3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine (PubChem CID 174278837) has the molecular formula C12H11N5O and a molecular weight of 241.25 g/mol. Its IUPAC name is 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine.

Molecular Properties

Compound Name3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
PubChem CID174278837
Molecular FormulaC12H11N5O
Molecular Weight241.25 g/mol
Exact Mass241.10
IUPAC Name3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
SMILESCOn1c(-c2cccnc2N)nc2cccnc21
InChIInChI=1S/C12H11N5O/c1-18-17-11(8-4-2-6-14-10(8)13)16-9-5-3-7-15-12(9)17/h2-7H,1H3,(H2,13,14)
InChIKeyBRMJLHNHLZWFMZ-UHFFFAOYSA-N
XLogP1.13
TPSA78.85 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.25
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The IUPAC name of 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine (CID 174278837) is 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine.
What is the SMILES notation for 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The canonical SMILES for 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine is COn1c(-c2cccnc2N)nc2cccnc21.
What is the InChIKey of 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
The InChIKey is BRMJLHNHLZWFMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5O/c1-18-17-11(8-4-2-6-14-10(8)13)16-9-5-3-7-15-12(9)17/h2-7H,1H3,(H2,13,14).
What are the key properties of 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine?
3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine has a molecular weight of 241.25 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-methoxyimidazo[4,5-b]pyridin-2-yl)pyridin-2-amine is sourced from PubChem (CID 174278837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).