3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine

C13H18N4O — CID 113488928

IUPAC3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCC1(n2c(N)nc3ccc(OC)nc32)CCC1
InChIInChI=1S/C13H18N4O/c1-3-13(7-4-8-13)17-11-9(15-12(17)14)5-6-10(16-11)18-2/h5-6H,3-4,7-8H2,1-2H3,(H2,14,15)
InChIKeyDCAVYKUGFGQUSZ-UHFFFAOYSA-N
MW246.31 g/mol
LogP2.31
Rot. Bonds3

About 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine

3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine (PubChem CID 113488928) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine.

Molecular Properties

Compound Name3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
PubChem CID113488928
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC Name3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
SMILESCCC1(n2c(N)nc3ccc(OC)nc32)CCC1
InChIInChI=1S/C13H18N4O/c1-3-13(7-4-8-13)17-11-9(15-12(17)14)5-6-10(16-11)18-2/h5-6H,3-4,7-8H2,1-2H3,(H2,14,15)
InChIKeyDCAVYKUGFGQUSZ-UHFFFAOYSA-N
XLogP2.31
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-methoxy-3-(2-methoxypropyl)imidazo[4,5-b]pyridin-2-amine
CID 102699356
3-(2,2-dimethylcyclopentyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322489
3-(cyclohexylmethyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322201
5-methoxy-3-(2-methylcycloheptyl)imidazo[4,5-b]pyridin-2-amine
CID 115322469
3-(4-ethylcyclohexyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322255
2-(2-chloroethyl)-5-methoxy-3-(1-methylcyclohexyl)imidazo[4,5-b]pyridine
CID 115322925
3-(3,3-dimethylcyclopentyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 114548374
3-(1-ethoxypropan-2-yl)-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322330
3-[(2-ethylphenyl)methyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322450
5-methoxy-3-(4-methylpentan-2-yl)imidazo[4,5-b]pyridin-2-amine
CID 115322202
3-[2-(dimethylamino)ethyl]-5-methoxyimidazo[4,5-b]pyridin-2-amine
CID 115322083
ethyl 4-(2-amino-5-methoxyimidazo[4,5-b]pyridin-3-yl)butanoate
CID 115322446

Frequently Asked Questions

What is the IUPAC name of 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The IUPAC name of 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine (CID 113488928) is 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine.
What is the SMILES notation for 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The canonical SMILES for 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine is CCC1(n2c(N)nc3ccc(OC)nc32)CCC1.
What is the InChIKey of 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
The InChIKey is DCAVYKUGFGQUSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O/c1-3-13(7-4-8-13)17-11-9(15-12(17)14)5-6-10(16-11)18-2/h5-6H,3-4,7-8H2,1-2H3,(H2,14,15).
What are the key properties of 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine?
3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine has a molecular weight of 246.31 g/mol, XLogP of 2.31, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethylcyclobutyl)-5-methoxyimidazo[4,5-b]pyridin-2-amine is sourced from PubChem (CID 113488928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).