2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine

C14H22N4O — CID 115430274

IUPAC2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine
SMILESCCOc1ccc2[nH]c(C(CC)(CC)CN)nc2n1
InChIInChI=1S/C14H22N4O/c1-4-14(5-2,9-15)13-16-10-7-8-11(19-6-3)17-12(10)18-13/h7-8H,4-6,9,15H2,1-3H3,(H,16,17,18)
InChIKeyXAAXNLHYWMSKLU-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.37
Rot. Bonds6

About 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine

2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine (PubChem CID 115430274) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine.

Molecular Properties

Compound Name2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine
PubChem CID115430274
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine
SMILESCCOc1ccc2[nH]c(C(CC)(CC)CN)nc2n1
InChIInChI=1S/C14H22N4O/c1-4-14(5-2,9-15)13-16-10-7-8-11(19-6-3)17-12(10)18-13/h7-8H,4-6,9,15H2,1-3H3,(H,16,17,18)
InChIKeyXAAXNLHYWMSKLU-UHFFFAOYSA-N
XLogP2.37
TPSA76.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-ethoxy-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79815994
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-1,1,1-trifluoropropan-2-amine
CID 79815424
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)cyclopentan-1-amine
CID 79815882
2-(4,5-difluoro-1H-benzimidazol-2-yl)-2-ethylbutan-1-amine
CID 112556635
4-bromo-3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)aniline
CID 115296290
4-[(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)methoxy]aniline
CID 79826712
3-amino-3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
CID 79815419
3-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)propan-1-ol
CID 79815532
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-N-methylethanamine
CID 79815427
6-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)heptan-2-amine
CID 79816332
4-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)pyridin-2-amine
CID 79816479
2-[2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)ethyl]aniline
CID 107272695

Frequently Asked Questions

What is the IUPAC name of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine?
The IUPAC name of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine (CID 115430274) is 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine.
What is the SMILES notation for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine?
The canonical SMILES for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine is CCOc1ccc2[nH]c(C(CC)(CC)CN)nc2n1.
What is the InChIKey of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine?
The InChIKey is XAAXNLHYWMSKLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-4-14(5-2,9-15)13-16-10-7-8-11(19-6-3)17-12(10)18-13/h7-8H,4-6,9,15H2,1-3H3,(H,16,17,18).
What are the key properties of 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine?
2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine has a molecular weight of 262.36 g/mol, XLogP of 2.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-ethoxy-1H-imidazo[4,5-b]pyridin-2-yl)-2-ethylbutan-1-amine is sourced from PubChem (CID 115430274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).