[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine

C15H16N4O — CID 82487584

IUPAC[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCCOc1ccc(-n2c(CN)nc3cccnc32)cc1
InChIInChI=1S/C15H16N4O/c1-2-20-12-7-5-11(6-8-12)19-14(10-16)18-13-4-3-9-17-15(13)19/h3-9H,2,10,16H2,1H3
InChIKeyVDXIRTSISFIKJI-UHFFFAOYSA-N
MW268.32 g/mol
LogP2.28
Rot. Bonds4

About [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine

[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine (PubChem CID 82487584) has the molecular formula C15H16N4O and a molecular weight of 268.32 g/mol. Its IUPAC name is [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine.

Molecular Properties

Compound Name[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
PubChem CID82487584
Molecular FormulaC15H16N4O
Molecular Weight268.32 g/mol
Exact Mass268.13
IUPAC Name[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
SMILESCCOc1ccc(-n2c(CN)nc3cccnc32)cc1
InChIInChI=1S/C15H16N4O/c1-2-20-12-7-5-11(6-8-12)19-14(10-16)18-13-4-3-9-17-15(13)19/h3-9H,2,10,16H2,1H3
InChIKeyVDXIRTSISFIKJI-UHFFFAOYSA-N
XLogP2.28
TPSA65.96 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 82481510
[3-(2,6-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 82481512
3-[3-(4-methoxyphenyl)imidazo[4,5-b]pyridin-2-yl]propan-1-ol
CID 117159759
3-(4-methylphenyl)-2-[[3-(4-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methoxymethyl]imidazo[4,5-b]pyridine
CID 20955885
N-(2-chlorophenyl)-4-[[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methyl]piperazine-1-carboxamide
CID 53022633
2-[3-(3,4-dimethylphenyl)imidazo[4,5-b]pyridin-2-yl]ethanamine
CID 82487047
[3-(3-chloro-2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine
CID 96668761
2-(2-chloroethyl)-3-(4-propylphenyl)imidazo[4,5-b]pyridine
CID 79273871
1-(4-ethoxyphenyl)benzimidazol-2-amine
CID 43148828
2-(chloromethyl)-3-(4-fluorophenyl)imidazo[4,5-b]pyridine
CID 79289700
2-(2-methylpropyl)-3-pyridin-4-ylimidazo[4,5-b]pyridine
CID 117166087
3-(4-methoxyphenyl)-2-propan-2-ylimidazo[4,5-b]pyridine
CID 117166531

Frequently Asked Questions

What is the IUPAC name of [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The IUPAC name of [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine (CID 82487584) is [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine.
What is the SMILES notation for [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The canonical SMILES for [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine is CCOc1ccc(-n2c(CN)nc3cccnc32)cc1.
What is the InChIKey of [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
The InChIKey is VDXIRTSISFIKJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O/c1-2-20-12-7-5-11(6-8-12)19-14(10-16)18-13-4-3-9-17-15(13)19/h3-9H,2,10,16H2,1H3.
What are the key properties of [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine?
[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine has a molecular weight of 268.32 g/mol, XLogP of 2.28, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-2-yl]methanamine is sourced from PubChem (CID 82487584), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).