3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine

C24H25N3O2 — CID 134179632

IUPAC3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine
SMILESCC(C)Oc1ccc(-c2ccc3ncn(-c4ccc(OC(C)C)cc4)c3n2)cc1
InChIInChI=1S/C24H25N3O2/c1-16(2)28-20-9-5-18(6-10-20)22-13-14-23-24(26-22)27(15-25-23)19-7-11-21(12-8-19)29-17(3)4/h5-17H,1-4H3
InChIKeyAIGFXGSSYIGCDV-UHFFFAOYSA-N
MW387.48 g/mol
LogP5.66
Rot. Bonds6

About 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine

3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine (PubChem CID 134179632) has the molecular formula C24H25N3O2 and a molecular weight of 387.48 g/mol. Its IUPAC name is 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine
PubChem CID134179632
Molecular FormulaC24H25N3O2
Molecular Weight387.48 g/mol
Exact Mass387.19
IUPAC Name3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine
SMILESCC(C)Oc1ccc(-c2ccc3ncn(-c4ccc(OC(C)C)cc4)c3n2)cc1
InChIInChI=1S/C24H25N3O2/c1-16(2)28-20-9-5-18(6-10-20)22-13-14-23-24(26-22)27(15-25-23)19-7-11-21(12-8-19)29-17(3)4/h5-17H,1-4H3
InChIKeyAIGFXGSSYIGCDV-UHFFFAOYSA-N
XLogP5.66
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500387.48
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3-(4-(2-Butyl-1-(4-(4-chlorophenoxy)phenyl)-1H-imidazol-4-yl)phenoxy)-N,N-diethyl-1-propanamine
CID 11180124
Etodesnitazene
CID 149797386
7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
Metodesnitazene
CID 26412
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 3641059
4-[2-Methyl-3-(2-phenoxyethyl)imidazo[4,5-b]pyridin-5-yl]pyridine-2,6-diamine
CID 135335939
1-(4-methoxybenzyl)-2-(4-methoxyphenyl)-1H-benzo(d)imidazole
CID 746182
9-butyl-8-(4-methoxybenzyl)-9H-purin-6-amine
CID 5289227
2-(4-Methoxyphenyl)imidazo[1,2-a]pyridine
CID 694963
2-(4-Ethoxyphenyl)imidazo[1,2-a]pyridine
CID 720519
2-(4-Propoxyphenyl)imidazo[1,2-a]pyridine
CID 2876085
Pyrimido(1,2-a)benzimidazole, 1,4-dihydro-4-(4-methoxyphenyl)-2-methyl-
CID 3074967

Frequently Asked Questions

What is the IUPAC name of 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine?
The IUPAC name of 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine (CID 134179632) is 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine.
What is the SMILES notation for 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine?
The canonical SMILES for 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine is CC(C)Oc1ccc(-c2ccc3ncn(-c4ccc(OC(C)C)cc4)c3n2)cc1.
What is the InChIKey of 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine?
The InChIKey is AIGFXGSSYIGCDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O2/c1-16(2)28-20-9-5-18(6-10-20)22-13-14-23-24(26-22)27(15-25-23)19-7-11-21(12-8-19)29-17(3)4/h5-17H,1-4H3.
What are the key properties of 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine?
3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine has a molecular weight of 387.48 g/mol, XLogP of 5.66, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-bis(4-propan-2-yloxyphenyl)imidazo[4,5-b]pyridine is sourced from PubChem (CID 134179632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).