3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine

C12H18N4 — CID 81073667

IUPAC3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine
SMILESCCn1c(CC(C)CN)nc2cccnc21
InChIInChI=1S/C12H18N4/c1-3-16-11(7-9(2)8-13)15-10-5-4-6-14-12(10)16/h4-6,9H,3,7-8,13H2,1-2H3
InChIKeyJFAQFABANGUHJW-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.59
Rot. Bonds4

About 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine

3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine (PubChem CID 81073667) has the molecular formula C12H18N4 and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine.

Molecular Properties

Compound Name3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine
PubChem CID81073667
Molecular FormulaC12H18N4
Molecular Weight218.30 g/mol
Exact Mass218.15
IUPAC Name3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine
SMILESCCn1c(CC(C)CN)nc2cccnc21
InChIInChI=1S/C12H18N4/c1-3-16-11(7-9(2)8-13)15-10-5-4-6-14-12(10)16/h4-6,9H,3,7-8,13H2,1-2H3
InChIKeyJFAQFABANGUHJW-UHFFFAOYSA-N
XLogP1.59
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methoxypropan-1-amine
CID 103153994
4-[1-(3-ethylimidazo[4,5-b]pyridin-2-yl)propan-2-yl]aniline
CID 104501918
2-butyl-3-ethylimidazo[4,5-b]pyridine
CID 150562237
2-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethoxy]ethanamine
CID 112739245
3-ethyl-2-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 117165475
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-1-phenylpropan-1-amine
CID 63757298
3-ethyl-2-methylimidazo[4,5-b]pyridine
CID 23298284
2-[(3-propan-2-ylimidazo[4,5-b]pyridin-2-yl)methyl]butan-1-amine
CID 81073284
2-(3-ethylimidazo[4,5-b]pyridin-2-yl)-4,4-dimethylpentan-1-amine
CID 107473033
1-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylbutan-1-amine
CID 63758341
3-(6-chloro-1-ethylbenzimidazol-2-yl)-2-methylpropan-1-amine
CID 113316610
3-ethyl-2-(piperazin-1-ylmethyl)imidazo[4,5-b]pyridine
CID 63757473

Frequently Asked Questions

What is the IUPAC name of 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine?
The IUPAC name of 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine (CID 81073667) is 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine.
What is the SMILES notation for 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine?
The canonical SMILES for 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine is CCn1c(CC(C)CN)nc2cccnc21.
What is the InChIKey of 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine?
The InChIKey is JFAQFABANGUHJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N4/c1-3-16-11(7-9(2)8-13)15-10-5-4-6-14-12(10)16/h4-6,9H,3,7-8,13H2,1-2H3.
What are the key properties of 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine?
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine has a molecular weight of 218.30 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine is sourced from PubChem (CID 81073667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).