2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine

C24H23N3O — CID 140715595

IUPAC2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine
SMILESCn1ccnc1-c1cccc(Oc2cccc(C(C)(C)c3ccccn3)c2)c1
InChIInChI=1S/C24H23N3O/c1-24(2,22-12-4-5-13-25-22)19-9-7-11-21(17-19)28-20-10-6-8-18(16-20)23-26-14-15-27(23)3/h4-17H,1-3H3
InChIKeyIMZMWTXEALRNQA-UHFFFAOYSA-N
MW369.47 g/mol
LogP5.60
Rot. Bonds5

About 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine

2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine (PubChem CID 140715595) has the molecular formula C24H23N3O and a molecular weight of 369.47 g/mol. Its IUPAC name is 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine.

Molecular Properties

Compound Name2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine
PubChem CID140715595
Molecular FormulaC24H23N3O
Molecular Weight369.47 g/mol
Exact Mass369.18
IUPAC Name2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine
SMILESCn1ccnc1-c1cccc(Oc2cccc(C(C)(C)c3ccccn3)c2)c1
InChIInChI=1S/C24H23N3O/c1-24(2,22-12-4-5-13-25-22)19-9-7-11-21(17-19)28-20-10-6-8-18(16-20)23-26-14-15-27(23)3/h4-17H,1-3H3
InChIKeyIMZMWTXEALRNQA-UHFFFAOYSA-N
XLogP5.60
TPSA39.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.47
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[3,6-ditert-butyl-9-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]fluoren-9-yl]pyridine
CID 140715658
2-[2-(3-methylphenyl)propan-2-yl]pyridine
CID 130252856
3,5-dimethyl-1-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]-4-phenylpyrazole
CID 140729613
2-[3-[3-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]phenyl]-2,2,4,4-tetramethylpentan-3-yl]pyridine
CID 140717143
1-methyl-2-(3-thiophen-2-ylphenyl)imidazole
CID 59348191
ethane;1-methyl-2-phenylimidazole
CID 142155183
2-(3-chlorophenyl)-1-methylimidazole
CID 57277272
2-[3-[3-[1-[2,6-di(propan-2-yl)phenyl]imidazol-2-yl]phenoxy]phenoxy]pyridine
CID 140803188
10-[3-(1-methylimidazol-2-yl)phenoxy]-12-pyridin-2-yl-[1]benzothiolo[3,2-a]carbazole
CID 140954347
1-methyl-2-(3-methylphenoxy)imidazole
CID 117189440
ethyl 2-[[3,5-difluoro-2-[3-(1-methylimidazol-2-yl)phenoxy]-4-pyridinyl]-ethylamino]-2-methylpropanoate
CID 152727225
1-[2,6-di(propan-2-yl)phenyl]-2-[3-[3-[1-[4-[4-(2-phenylimidazol-1-yl)-3,5-di(propan-2-yl)phenyl]-2,6-di(propan-2-yl)phenyl]imidazol-2-yl]phenoxy]phenyl]imidazole
CID 140803144

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine?
The IUPAC name of 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine (CID 140715595) is 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine.
What is the SMILES notation for 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine?
The canonical SMILES for 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine is Cn1ccnc1-c1cccc(Oc2cccc(C(C)(C)c3ccccn3)c2)c1.
What is the InChIKey of 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine?
The InChIKey is IMZMWTXEALRNQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23N3O/c1-24(2,22-12-4-5-13-25-22)19-9-7-11-21(17-19)28-20-10-6-8-18(16-20)23-26-14-15-27(23)3/h4-17H,1-3H3.
What are the key properties of 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine?
2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine has a molecular weight of 369.47 g/mol, XLogP of 5.60, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-[3-(1-methylimidazol-2-yl)phenoxy]phenyl]propan-2-yl]pyridine is sourced from PubChem (CID 140715595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).