3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine

C15H16N4O — CID 81138533

IUPAC3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCCOc1ccc(-n2c(N)nc3ccc(C)nc32)cc1
InChIInChI=1S/C15H16N4O/c1-3-20-12-7-5-11(6-8-12)19-14-13(18-15(19)16)9-4-10(2)17-14/h4-9H,3H2,1-2H3,(H2,16,18)
InChIKeyNMLVXKGAEXVQIE-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.71
Rot. Bonds3

About 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine

3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine (PubChem CID 81138533) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
PubChem CID81138533
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCCOc1ccc(-n2c(N)nc3ccc(C)nc32)cc1
InChIInChI=1S/C15H16N4O/c1-3-20-12-7-5-11(6-8-12)19-14-13(18-15(19)16)9-4-10(2)17-14/h4-9H,3H2,1-2H3,(H2,16,18)
InChIKeyNMLVXKGAEXVQIE-UHFFFAOYSA-N
XLogP2.71
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine (CID 81138533) is 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine is CCOc1ccc(-n2c(N)nc3ccc(C)nc32)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The InChIKey is NMLVXKGAEXVQIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-3-20-12-7-5-11(6-8-12)19-14-13(18-15(19)16)9-4-10(2)17-14/h4-9H,3H2,1-2H3,(H2,16,18).
What are the key properties of 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine has a molecular weight of 268.32 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 81138533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).