3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine

C24H25N3O — CID 174999076

IUPAC3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine
SMILESCCOc1ccc(-n2cnc3cc(C(C)c4ccc(CC)cc4)cnc32)cc1
InChIInChI=1S/C24H25N3O/c1-4-18-6-8-19(9-7-18)17(3)20-14-23-24(25-15-20)27(16-26-23)21-10-12-22(13-11-21)28-5-2/h6-17H,4-5H2,1-3H3
InChIKeyKZLPMAIBUZSDPN-UHFFFAOYSA-N
MW371.48 g/mol
LogP5.53
Rot. Bonds6

About 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine

3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine (PubChem CID 174999076) has the molecular formula C24H25N3O and a molecular weight of 371.48 g/mol. Its IUPAC name is 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine
PubChem CID174999076
Molecular FormulaC24H25N3O
Molecular Weight371.48 g/mol
Exact Mass371.20
IUPAC Name3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine
SMILESCCOc1ccc(-n2cnc3cc(C(C)c4ccc(CC)cc4)cnc32)cc1
InChIInChI=1S/C24H25N3O/c1-4-18-6-8-19(9-7-18)17(3)20-14-23-24(25-15-20)27(16-26-23)21-10-12-22(13-11-21)28-5-2/h6-17H,4-5H2,1-3H3
InChIKeyKZLPMAIBUZSDPN-UHFFFAOYSA-N
XLogP5.53
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.48
LogP ≤ 55.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-6-yl]-N-[(4-ethylphenyl)methyl]methanesulfonamide
CID 42602700
N-[3-(4-ethoxyphenyl)imidazo[4,5-b]pyridin-6-yl]-N-[(4-ethylphenyl)methyl]benzenesulfonamide
CID 42602773
3-[3-(aminomethyl)-4-ethoxyphenyl]-N-[(4-ethylphenyl)methyl]imidazo[4,5-b]pyridin-6-amine
CID 71521187
1-(4-ethoxyphenyl)benzimidazole
CID 175001446
1-(4-ethylphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine
CID 66793952
5-[(Z)-2-(4-ethylphenyl)ethenyl]-1-(4-propan-2-ylphenyl)benzimidazole
CID 151682330
N-[1-(4-ethoxyphenyl)ethyl]-4-ethylaniline
CID 43093553
trans-(1S,3S)-3-[[9-(4-ethoxyphenyl)purin-2-yl]amino]cyclopentan-1-ol
CID 90389969
2-chloro-9-(4-propan-2-yloxyphenyl)purine
CID 134179375
1-(4-methoxyphenyl)-N-[(4-propan-2-ylphenyl)methyl]benzimidazol-5-amine;hydrochloride
CID 127020969
1-ethyl-4-[(4-propan-2-ylphenyl)methoxy]benzene
CID 59709478
2-[1-(4-ethoxyphenyl)ethyl]-5-hexylpyridine
CID 19858713

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine?
The IUPAC name of 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine (CID 174999076) is 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine.
What is the SMILES notation for 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine?
The canonical SMILES for 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine is CCOc1ccc(-n2cnc3cc(C(C)c4ccc(CC)cc4)cnc32)cc1.
What is the InChIKey of 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine?
The InChIKey is KZLPMAIBUZSDPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O/c1-4-18-6-8-19(9-7-18)17(3)20-14-23-24(25-15-20)27(16-26-23)21-10-12-22(13-11-21)28-5-2/h6-17H,4-5H2,1-3H3.
What are the key properties of 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine?
3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine has a molecular weight of 371.48 g/mol, XLogP of 5.53, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxyphenyl)-6-[1-(4-ethylphenyl)ethyl]imidazo[4,5-b]pyridine is sourced from PubChem (CID 174999076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).