1-butyl-2,3-diphenyl-2H-imidazole

C19H22N2 — CID 69391122

IUPAC1-butyl-2,3-diphenyl-2H-imidazole
SMILESCCCCN1C=CN(c2ccccc2)C1c1ccccc1
InChIInChI=1S/C19H22N2/c1-2-3-14-20-15-16-21(18-12-8-5-9-13-18)19(20)17-10-6-4-7-11-17/h4-13,15-16,19H,2-3,14H2,1H3
InChIKeyZUGHEEOJYBNGAP-UHFFFAOYSA-N
MW278.40 g/mol
LogP4.78
Rot. Bonds5

About 1-butyl-2,3-diphenyl-2H-imidazole

1-butyl-2,3-diphenyl-2H-imidazole (PubChem CID 69391122) has the molecular formula C19H22N2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 1-butyl-2,3-diphenyl-2H-imidazole.

Molecular Properties

Compound Name1-butyl-2,3-diphenyl-2H-imidazole
PubChem CID69391122
Molecular FormulaC19H22N2
Molecular Weight278.40 g/mol
Exact Mass278.18
IUPAC Name1-butyl-2,3-diphenyl-2H-imidazole
SMILESCCCCN1C=CN(c2ccccc2)C1c1ccccc1
InChIInChI=1S/C19H22N2/c1-2-3-14-20-15-16-21(18-12-8-5-9-13-18)19(20)17-10-6-4-7-11-17/h4-13,15-16,19H,2-3,14H2,1H3
InChIKeyZUGHEEOJYBNGAP-UHFFFAOYSA-N
XLogP4.78
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-butyl-3-nonadecyl-2-phenyl-2H-imidazole
CID 69390224
2-phenyl-1-tetradecyl-3-tridecyl-2H-imidazole
CID 69390233
1-dodecyl-3-nonadecyl-2-phenyl-2H-imidazole
CID 69388228
1-heptadecyl-3-nonadecyl-2-phenyl-2H-imidazole
CID 69388930
1-dodecyl-3-pentyl-2-phenyl-2H-imidazole
CID 69395234
1-nonadecyl-2-phenyl-3-undecyl-2H-imidazole
CID 69392101
1-nonadecyl-3-pentyl-2-phenyl-2H-imidazole
CID 69388313
1-nonadecyl-2-phenyl-3-propyl-2H-imidazole
CID 69392531
1-decyl-2-phenyl-3-propyl-2H-imidazole
CID 69389510
1-butyl-2-heptadecyl-3-phenyl-2H-imidazole
CID 69396809
1-butyl-3-(pentoxymethyl)-2-phenyl-2H-imidazole
CID 71340636
1-hexadecyl-2-octyl-3-phenyl-2H-imidazole
CID 69393141

Frequently Asked Questions

What is the IUPAC name of 1-butyl-2,3-diphenyl-2H-imidazole?
The IUPAC name of 1-butyl-2,3-diphenyl-2H-imidazole (CID 69391122) is 1-butyl-2,3-diphenyl-2H-imidazole.
What is the SMILES notation for 1-butyl-2,3-diphenyl-2H-imidazole?
The canonical SMILES for 1-butyl-2,3-diphenyl-2H-imidazole is CCCCN1C=CN(c2ccccc2)C1c1ccccc1.
What is the InChIKey of 1-butyl-2,3-diphenyl-2H-imidazole?
The InChIKey is ZUGHEEOJYBNGAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2/c1-2-3-14-20-15-16-21(18-12-8-5-9-13-18)19(20)17-10-6-4-7-11-17/h4-13,15-16,19H,2-3,14H2,1H3.
What are the key properties of 1-butyl-2,3-diphenyl-2H-imidazole?
1-butyl-2,3-diphenyl-2H-imidazole has a molecular weight of 278.40 g/mol, XLogP of 4.78, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-2,3-diphenyl-2H-imidazole is sourced from PubChem (CID 69391122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).