6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine

C30H29N3O2 — CID 59243146

IUPAC6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cccc(C)c1-c1cnc2nc(-c3ccc(OCc4ccccc4)cc3OC(C)C)[nH]c2c1
InChIInChI=1S/C30H29N3O2/c1-19(2)35-27-16-24(34-18-22-11-6-5-7-12-22)13-14-25(27)29-32-26-15-23(17-31-30(26)33-29)28-20(3)9-8-10-21(28)4/h5-17,19H,18H2,1-4H3,(H,31,32,33)
InChIKeyUVBOSDSDZYSBCR-UHFFFAOYSA-N
MW463.58 g/mol
LogP7.27
Rot. Bonds7

About 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine

6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 59243146) has the molecular formula C30H29N3O2 and a molecular weight of 463.58 g/mol. Its IUPAC name is 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine
PubChem CID59243146
Molecular FormulaC30H29N3O2
Molecular Weight463.58 g/mol
Exact Mass463.23
IUPAC Name6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine
SMILESCc1cccc(C)c1-c1cnc2nc(-c3ccc(OCc4ccccc4)cc3OC(C)C)[nH]c2c1
InChIInChI=1S/C30H29N3O2/c1-19(2)35-27-16-24(34-18-22-11-6-5-7-12-22)13-14-25(27)29-32-26-15-23(17-31-30(26)33-29)28-20(3)9-8-10-21(28)4/h5-17,19H,18H2,1-4H3,(H,31,32,33)
InChIKeyUVBOSDSDZYSBCR-UHFFFAOYSA-N
XLogP7.27
TPSA60.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms35
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.58
LogP ≤ 57.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine with MolForge

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Related Compounds

2-[2-(2-methylpropyl)-5-propan-2-yloxyphenyl]-6-phenyl-1H-imidazo[4,5-b]pyridine
CID 67489996
2-[2,4-bis(phenylmethoxy)phenyl]-1H-imidazo[4,5-b]pyridine-6-carboxylic acid;2,2,2-trifluoroacetic acid
CID 66776090
2-(3-propan-2-yloxynaphthalen-2-yl)-1H-imidazo[4,5-b]pyridine
CID 13304825
2-chloro-4-phenylmethoxy-1-propan-2-yloxybenzene
CID 50888763
4-methyl-6-[2-[6-(3-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridin-2-yl]ethyl]pyridin-2-amine
CID 11247561
6-bromo-2-(3-methoxy-4-phenylmethoxyphenyl)-1H-imidazo[4,5-b]pyridine
CID 69214242
7-phenylmethoxy-5-propan-2-yloxy-1,4-dihydroquinazoline
CID 141088855
2-[3,5-bis(phenylmethoxy)phenyl]-6-pent-1-en-2-yl-1H-imidazo[4,5-b]pyridine
CID 67490039
5-(2-methoxy-4-phenylmethoxyphenyl)-2-phenyl-1H-imidazole;hydrochloride
CID 158418618
2-[5-phenylmethoxy-2-(pyridin-3-ylmethoxy)phenyl]-1H-imidazo[4,5-b]pyridine;bis(2,2,2-trifluoroacetic acid)
CID 87145898
2-(3-butan-2-yloxyphenyl)-6-(2-fluorophenyl)-1H-imidazo[4,5-b]pyridine
CID 68894960
methane;2-[3-propan-2-yloxy-5-(pyridin-4-ylmethoxy)phenyl]-1H-imidazo[4,5-b]pyridine
CID 157077401

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine (CID 59243146) is 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine is Cc1cccc(C)c1-c1cnc2nc(-c3ccc(OCc4ccccc4)cc3OC(C)C)[nH]c2c1.
What is the InChIKey of 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is UVBOSDSDZYSBCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H29N3O2/c1-19(2)35-27-16-24(34-18-22-11-6-5-7-12-22)13-14-25(27)29-32-26-15-23(17-31-30(26)33-29)28-20(3)9-8-10-21(28)4/h5-17,19H,18H2,1-4H3,(H,31,32,33).
What are the key properties of 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine?
6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 463.58 g/mol, XLogP of 7.27, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethylphenyl)-2-(4-phenylmethoxy-2-propan-2-yloxyphenyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 59243146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).