4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol

C22H20N2O2 — CID 134179819

IUPAC4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1
InChIInChI=1S/C22H20N2O2/c1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h3-15,25H,1-2H3
InChIKeyXMNMRQXUAYDCAP-UHFFFAOYSA-N
MW344.41 g/mol
LogP5.16
Rot. Bonds4

About 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol

4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol (PubChem CID 134179819) has the molecular formula C22H20N2O2 and a molecular weight of 344.41 g/mol. Its IUPAC name is 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol.

Molecular Properties

Compound Name4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol
PubChem CID134179819
Molecular FormulaC22H20N2O2
Molecular Weight344.41 g/mol
Exact Mass344.15
IUPAC Name4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol
SMILESCC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1
InChIInChI=1S/C22H20N2O2/c1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h3-15,25H,1-2H3
InChIKeyXMNMRQXUAYDCAP-UHFFFAOYSA-N
XLogP5.16
TPSA46.76 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.41
LogP ≤ 55.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Sch 28080
CID 108137
7-Methyl-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]-6-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridine
CID 146659124
7-butyl-6-(4-methoxyphenyl)-5H-pyrrolo[2,3-b]pyrazine
CID 3641059
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
Coelenterazine
CID 135445694
3-(6-Methoxypyridin-2-yl)-7-phenylimidazo[1,2-a]pyridine
CID 5329342
1-phenyl-5-{4-[2-(piperidin-1-yl)ethoxy]phenyl}-1H-1,3-benzodiazole
CID 5329412
1-[2-(4-{3-phenyl-3H-imidazo[4,5-b]pyridin-6-yl}phenoxy)ethyl]piperidine
CID 5329413
6-(4-methoxyphenyl)-7-propyl-5H-pyrrolo[2,3-b]pyrazine
CID 6538784
6-phenyl[5H]pyrrolo[2,3-b]pyrazine (aloisine) 36
CID 6538786

Frequently Asked Questions

What is the IUPAC name of 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol?
The IUPAC name of 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol (CID 134179819) is 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol.
What is the SMILES notation for 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol?
The canonical SMILES for 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol is CC(C)Oc1ccc(-c2cnc3ccc(-c4ccc(O)cc4)cn23)cc1.
What is the InChIKey of 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol?
The InChIKey is XMNMRQXUAYDCAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N2O2/c1-15(2)26-20-10-5-17(6-11-20)21-13-23-22-12-7-18(14-24(21)22)16-3-8-19(25)9-4-16/h3-15,25H,1-2H3.
What are the key properties of 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol?
4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol has a molecular weight of 344.41 g/mol, XLogP of 5.16, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-6-yl]phenol is sourced from PubChem (CID 134179819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).