5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole

C26H28N2O2 — CID 157407321

IUPAC5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole
SMILESCCc1ccc(C2=NC(c3ccc(OC)cc3)N(c3ccc(OC)cc3)C2C)cc1
InChIInChI=1S/C26H28N2O2/c1-5-19-6-8-20(9-7-19)25-18(2)28(22-12-16-24(30-4)17-13-22)26(27-25)21-10-14-23(29-3)15-11-21/h6-18,26H,5H2,1-4H3
InChIKeyRXZMUGHZKYVEMT-UHFFFAOYSA-N
MW400.52 g/mol
LogP5.66
Rot. Bonds6

About 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole

5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole (PubChem CID 157407321) has the molecular formula C26H28N2O2 and a molecular weight of 400.52 g/mol. Its IUPAC name is 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole.

Molecular Properties

Compound Name5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole
PubChem CID157407321
Molecular FormulaC26H28N2O2
Molecular Weight400.52 g/mol
Exact Mass400.22
IUPAC Name5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole
SMILESCCc1ccc(C2=NC(c3ccc(OC)cc3)N(c3ccc(OC)cc3)C2C)cc1
InChIInChI=1S/C26H28N2O2/c1-5-19-6-8-20(9-7-19)25-18(2)28(22-12-16-24(30-4)17-13-22)26(27-25)21-10-14-23(29-3)15-11-21/h6-18,26H,5H2,1-4H3
InChIKeyRXZMUGHZKYVEMT-UHFFFAOYSA-N
XLogP5.66
TPSA34.06 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.52
LogP ≤ 55.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

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Related Compounds

2,5-bis(4-methoxyphenyl)-4-methyl-3-[4-(4-methylphenyl)phenyl]-2,4-dihydroimidazole
CID 166797832
[4-[3-(4-bromophenyl)-2-(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazol-5-yl]phenyl] hypoiodite
CID 163790890
3-(4-chlorophenyl)-5-(4-ethylphenyl)-4-methyl-2-phenyl-2,4-dihydroimidazole
CID 157205263
2,5-bis(4-chlorophenyl)-4-methyl-3-(4-methylphenyl)-2,4-dihydroimidazole;2,5-bis(4-methoxyphenyl)-4-methyl-3-phenyl-2,4-dihydroimidazole;3-(4-chlorophenyl)-5-(4-methoxyphenyl)-4-methyl-2-phenyl-2,4-dihydroimidazole;5-(4-methoxyphenyl)-4-methyl-3-(4-methylphenyl)-2-phenyl-2,4-dihydroimidazole;4-methyl-2,3,5-triphenyl-2,4-dihydroimidazole
CID 159295723
5-(2,4-dichlorophenyl)-3-[4-(4-methoxyphenyl)phenyl]-4-methyl-2-phenyl-2,4-dihydroimidazole
CID 142423499
4-methyl-5-(4-methylphenyl)-2,3-diphenyl-2,4-dihydroimidazole
CID 157432449
1-(4-ethylphenyl)-4-(4-methoxyphenyl)piperidine
CID 166657002
1-ethyl-4-methylbenzene;methane;1-methoxy-4-methylbenzene;1,4-xylene
CID 157430816
5-(4-ethylphenyl)-3-(4-methoxyphenyl)triazol-4-amine
CID 82370104
(2S,3S)-2,3-diethyl-1-(4-methoxyphenyl)aziridine
CID 156901039
1,3-diethylbenzene;1,4-diethylbenzene;1,4-dimethoxybenzene;1-ethyl-4-methoxybenzene;1-methoxy-4-(4-methoxyphenyl)benzene;pentahydrate
CID 159257334
2-(4-chlorophenyl)-4-(4-methoxyphenyl)-6-phenyl-1,3-diazabicyclo[3.1.0]hex-3-ene
CID 4169624

Frequently Asked Questions

What is the IUPAC name of 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole?
The IUPAC name of 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole (CID 157407321) is 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole.
What is the SMILES notation for 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole?
The canonical SMILES for 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole is CCc1ccc(C2=NC(c3ccc(OC)cc3)N(c3ccc(OC)cc3)C2C)cc1.
What is the InChIKey of 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole?
The InChIKey is RXZMUGHZKYVEMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H28N2O2/c1-5-19-6-8-20(9-7-19)25-18(2)28(22-12-16-24(30-4)17-13-22)26(27-25)21-10-14-23(29-3)15-11-21/h6-18,26H,5H2,1-4H3.
What are the key properties of 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole?
5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole has a molecular weight of 400.52 g/mol, XLogP of 5.66, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-ethylphenyl)-2,3-bis(4-methoxyphenyl)-4-methyl-2,4-dihydroimidazole is sourced from PubChem (CID 157407321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).