N,1-dibenzyl-4,5-diphenylimidazol-2-amine

C29H25N3 — CID 66561407

IUPACN,1-dibenzyl-4,5-diphenylimidazol-2-amine
SMILESc1ccc(CNc2nc(-c3ccccc3)c(-c3ccccc3)n2Cc2ccccc2)cc1
InChIInChI=1S/C29H25N3/c1-5-13-23(14-6-1)21-30-29-31-27(25-17-9-3-10-18-25)28(26-19-11-4-12-20-26)32(29)22-24-15-7-2-8-16-24/h1-20H,21-22H2,(H,30,31)
InChIKeyCGZDFBQOOJAZET-UHFFFAOYSA-N
MW415.54 g/mol
LogP6.88
Rot. Bonds7

About N,1-dibenzyl-4,5-diphenylimidazol-2-amine

N,1-dibenzyl-4,5-diphenylimidazol-2-amine (PubChem CID 66561407) has the molecular formula C29H25N3 and a molecular weight of 415.54 g/mol. Its IUPAC name is N,1-dibenzyl-4,5-diphenylimidazol-2-amine.

Molecular Properties

Compound NameN,1-dibenzyl-4,5-diphenylimidazol-2-amine
PubChem CID66561407
Molecular FormulaC29H25N3
Molecular Weight415.54 g/mol
Exact Mass415.20
IUPAC NameN,1-dibenzyl-4,5-diphenylimidazol-2-amine
SMILESc1ccc(CNc2nc(-c3ccccc3)c(-c3ccccc3)n2Cc2ccccc2)cc1
InChIInChI=1S/C29H25N3/c1-5-13-23(14-6-1)21-30-29-31-27(25-17-9-3-10-18-25)28(26-19-11-4-12-20-26)32(29)22-24-15-7-2-8-16-24/h1-20H,21-22H2,(H,30,31)
InChIKeyCGZDFBQOOJAZET-UHFFFAOYSA-N
XLogP6.88
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500415.54
LogP ≤ 56.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4,5-diphenyl-2-propan-2-ylimidazole
CID 102274301
1-benzyl-2-(4-iodophenyl)-4,5-diphenylimidazole
CID 139218774
3-(1-benzyl-4,5-diphenylimidazol-2-yl)phenol
CID 11014921
1-benzyl-N-[[4-(dimethylamino)phenyl]methyl]benzimidazol-2-amine;dihydrochloride
CID 2870437
1-benzyl-N-[(1-benzylbenzimidazol-2-yl)methyl]benzimidazol-2-amine
CID 2859099
N,1-bis[(4-fluorophenyl)methyl]benzimidazol-2-amine
CID 11595468
3-benzyl-2-(benzylamino)-[1,3,5]triazino[1,2-a]benzimidazol-4-one
CID 15012861
2-(1-benzyl-4,5-diphenylimidazol-2-yl)sulfanyl-N-cyclopropylacetamide
CID 18269176
2-N,4-N,6-N-tribenzyl-1,3,5-triazine-2,4,6-triamine
CID 11372871
N-[(dimethylamino)methyl]-2-[4-[(2,4,5-triphenylimidazol-1-yl)methyl]phenyl]benzenesulfonamide
CID 70146598
1-[(3,4-dimethoxyphenyl)methyl]-2,4,5-triphenylimidazole
CID 134953177
N-benzyl-2,4-diphenyl-1,3-oxazol-5-amine
CID 16759411

Frequently Asked Questions

What is the IUPAC name of N,1-dibenzyl-4,5-diphenylimidazol-2-amine?
The IUPAC name of N,1-dibenzyl-4,5-diphenylimidazol-2-amine (CID 66561407) is N,1-dibenzyl-4,5-diphenylimidazol-2-amine.
What is the SMILES notation for N,1-dibenzyl-4,5-diphenylimidazol-2-amine?
The canonical SMILES for N,1-dibenzyl-4,5-diphenylimidazol-2-amine is c1ccc(CNc2nc(-c3ccccc3)c(-c3ccccc3)n2Cc2ccccc2)cc1.
What is the InChIKey of N,1-dibenzyl-4,5-diphenylimidazol-2-amine?
The InChIKey is CGZDFBQOOJAZET-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H25N3/c1-5-13-23(14-6-1)21-30-29-31-27(25-17-9-3-10-18-25)28(26-19-11-4-12-20-26)32(29)22-24-15-7-2-8-16-24/h1-20H,21-22H2,(H,30,31).
What are the key properties of N,1-dibenzyl-4,5-diphenylimidazol-2-amine?
N,1-dibenzyl-4,5-diphenylimidazol-2-amine has a molecular weight of 415.54 g/mol, XLogP of 6.88, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dibenzyl-4,5-diphenylimidazol-2-amine is sourced from PubChem (CID 66561407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).