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

C15H16N4O2 — CID 81141726

IUPAC3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc(OC)c(-n2c(N)nc3ccc(C)nc32)c1
InChIInChI=1S/C15H16N4O2/c1-9-4-6-11-14(17-9)19(15(16)18-11)12-8-10(20-2)5-7-13(12)21-3/h4-8H,1-3H3,(H2,16,18)
InChIKeyYZRGGWCGQRUQIM-UHFFFAOYSA-N
MW284.32 g/mol
LogP2.33
Rot. Bonds3

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

3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine (PubChem CID 81141726) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
PubChem CID81141726
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine
SMILESCOc1ccc(OC)c(-n2c(N)nc3ccc(C)nc32)c1
InChIInChI=1S/C15H16N4O2/c1-9-4-6-11-14(17-9)19(15(16)18-11)12-8-10(20-2)5-7-13(12)21-3/h4-8H,1-3H3,(H2,16,18)
InChIKeyYZRGGWCGQRUQIM-UHFFFAOYSA-N
XLogP2.33
TPSA75.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine (CID 81141726) is 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine is COc1ccc(OC)c(-n2c(N)nc3ccc(C)nc32)c1.
What is the InChIKey of 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
The InChIKey is YZRGGWCGQRUQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-9-4-6-11-14(17-9)19(15(16)18-11)12-8-10(20-2)5-7-13(12)21-3/h4-8H,1-3H3,(H2,16,18).
What are the key properties of 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine?
3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine has a molecular weight of 284.32 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,5-dimethoxyphenyl)-5-methylimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 81141726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).