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

C15H22N4O — CID 115322255

IUPAC3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCC1CCC(n2c(N)nc3ccc(OC)nc32)CC1
InChIInChI=1S/C15H22N4O/c1-3-10-4-6-11(7-5-10)19-14-12(17-15(19)16)8-9-13(18-14)20-2/h8-11H,3-7H2,1-2H3,(H2,16,17)
InChIKeyQYZWZHDGFSDDFI-UHFFFAOYSA-N
MW274.37 g/mol
LogP3.16
Rot. Bonds3

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

3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine (PubChem CID 115322255) has the molecular formula C15H22N4O and a molecular weight of 274.37 g/mol. Its IUPAC name is 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
PubChem CID115322255
Molecular FormulaC15H22N4O
Molecular Weight274.37 g/mol
Exact Mass274.18
IUPAC Name3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCC1CCC(n2c(N)nc3ccc(OC)nc32)CC1
InChIInChI=1S/C15H22N4O/c1-3-10-4-6-11(7-5-10)19-14-12(17-15(19)16)8-9-13(18-14)20-2/h8-11H,3-7H2,1-2H3,(H2,16,17)
InChIKeyQYZWZHDGFSDDFI-UHFFFAOYSA-N
XLogP3.16
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine (CID 115322255) is 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine is CCC1CCC(n2c(N)nc3ccc(OC)nc32)CC1.
What is the InChIKey of 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The InChIKey is QYZWZHDGFSDDFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O/c1-3-10-4-6-11(7-5-10)19-14-12(17-15(19)16)8-9-13(18-14)20-2/h8-11H,3-7H2,1-2H3,(H2,16,17).
What are the key properties of 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine has a molecular weight of 274.37 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 115322255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).