2-butyl-3-ethylimidazo[4,5-b]pyridine

C12H17N3 — CID 150562237

IUPAC2-butyl-3-ethylimidazo[4,5-b]pyridine
SMILESCCCCc1nc2cccnc2n1CC
InChIInChI=1S/C12H17N3/c1-3-5-8-11-14-10-7-6-9-13-12(10)15(11)4-2/h6-7,9H,3-5,8H2,1-2H3
InChIKeyIKBSZBOXLBWXAX-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.79
Rot. Bonds4

About 2-butyl-3-ethylimidazo[4,5-b]pyridine

2-butyl-3-ethylimidazo[4,5-b]pyridine (PubChem CID 150562237) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-butyl-3-ethylimidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-butyl-3-ethylimidazo[4,5-b]pyridine
PubChem CID150562237
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name2-butyl-3-ethylimidazo[4,5-b]pyridine
SMILESCCCCc1nc2cccnc2n1CC
InChIInChI=1S/C12H17N3/c1-3-5-8-11-14-10-7-6-9-13-12(10)15(11)4-2/h6-7,9H,3-5,8H2,1-2H3
InChIKeyIKBSZBOXLBWXAX-UHFFFAOYSA-N
XLogP2.79
TPSA30.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-methoxypropyl)-3-propylimidazo[4,5-b]pyridine
CID 117159722
2-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethoxy]ethanamine
CID 112739245
N-[2-(3-ethylimidazo[4,5-b]pyridin-2-yl)ethyl]cyclopropanamine
CID 63758859
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
3-(2-methoxyethyl)-2-[3-[3-(2-methoxyethyl)imidazo[4,5-b]pyridin-2-yl]propyl]imidazo[4,5-b]pyridine
CID 20955418
2-ethyl-3-propylimidazo[4,5-b]pyridine
CID 20777190
3-ethyl-2-[(4-fluorophenyl)methyl]imidazo[4,5-b]pyridine
CID 117165475
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methylpropan-1-amine
CID 81073667
3-ethyl-2-(piperazin-1-ylmethyl)imidazo[4,5-b]pyridine
CID 63757473
3-(3-ethylimidazo[4,5-b]pyridin-2-yl)-2-methoxypropan-1-amine
CID 103153994
1-ethyl-2-pentylbenzimidazole
CID 3463966

Frequently Asked Questions

What is the IUPAC name of 2-butyl-3-ethylimidazo[4,5-b]pyridine?
The IUPAC name of 2-butyl-3-ethylimidazo[4,5-b]pyridine (CID 150562237) is 2-butyl-3-ethylimidazo[4,5-b]pyridine.
What is the SMILES notation for 2-butyl-3-ethylimidazo[4,5-b]pyridine?
The canonical SMILES for 2-butyl-3-ethylimidazo[4,5-b]pyridine is CCCCc1nc2cccnc2n1CC.
What is the InChIKey of 2-butyl-3-ethylimidazo[4,5-b]pyridine?
The InChIKey is IKBSZBOXLBWXAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-3-5-8-11-14-10-7-6-9-13-12(10)15(11)4-2/h6-7,9H,3-5,8H2,1-2H3.
What are the key properties of 2-butyl-3-ethylimidazo[4,5-b]pyridine?
2-butyl-3-ethylimidazo[4,5-b]pyridine has a molecular weight of 203.29 g/mol, XLogP of 2.79, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-3-ethylimidazo[4,5-b]pyridine is sourced from PubChem (CID 150562237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).