4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine

C22H23N5 — CID 50963775

IUPAC4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine
SMILESCCCCc1ncc(-c2c(-c3ccccc3)ncn2Cc2ccncc2)[nH]1
InChIInChI=1S/C22H23N5/c1-2-3-9-20-24-14-19(26-20)22-21(18-7-5-4-6-8-18)25-16-27(22)15-17-10-12-23-13-11-17/h4-8,10-14,16H,2-3,9,15H2,1H3,(H,24,26)
InChIKeyQCQJUKCLGZPGIF-UHFFFAOYSA-N
MW357.46 g/mol
LogP4.73
Rot. Bonds7

About 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine

4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine (PubChem CID 50963775) has the molecular formula C22H23N5 and a molecular weight of 357.46 g/mol. Its IUPAC name is 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine.

Molecular Properties

Compound Name4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine
PubChem CID50963775
Molecular FormulaC22H23N5
Molecular Weight357.46 g/mol
Exact Mass357.20
IUPAC Name4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine
SMILESCCCCc1ncc(-c2c(-c3ccccc3)ncn2Cc2ccncc2)[nH]1
InChIInChI=1S/C22H23N5/c1-2-3-9-20-24-14-19(26-20)22-21(18-7-5-4-6-8-18)25-16-27(22)15-17-10-12-23-13-11-17/h4-8,10-14,16H,2-3,9,15H2,1H3,(H,24,26)
InChIKeyQCQJUKCLGZPGIF-UHFFFAOYSA-N
XLogP4.73
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.46
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(2-butyl-1H-imidazol-5-yl)-1-[2-[(2S)-1-methylpyrrolidin-2-yl]ethyl]-4-phenylimidazole
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CID 67753296
4,5-diphenyl-1-propylimidazole
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CID 173009112
2-benzyl-5-(3-butylphenyl)-1H-imidazole
CID 91210581
azane;5-phenyl-2-(3-phenylpropyl)-1H-imidazole
CID 174441840
3,5-dimethyl-4-[3-[5-(2-methyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]propyl]-1H-pyrazole
CID 50965339
5-(5-phenyl-1H-imidazol-2-yl)pentan-1-amine
CID 43651216
1-benzyl-5-butylimidazole
CID 10059100
1-[[2-[(4,5-diphenylimidazol-1-yl)methyl]phenyl]methyl]-4,5-diphenylimidazole
CID 15794352
4-[3-[2-(1H-imidazol-5-yl)ethyl]-5-phenylimidazol-4-yl]pyridine
CID 50957636

Frequently Asked Questions

What is the IUPAC name of 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine?
The IUPAC name of 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine (CID 50963775) is 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine.
What is the SMILES notation for 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine?
The canonical SMILES for 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine is CCCCc1ncc(-c2c(-c3ccccc3)ncn2Cc2ccncc2)[nH]1.
What is the InChIKey of 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine?
The InChIKey is QCQJUKCLGZPGIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23N5/c1-2-3-9-20-24-14-19(26-20)22-21(18-7-5-4-6-8-18)25-16-27(22)15-17-10-12-23-13-11-17/h4-8,10-14,16H,2-3,9,15H2,1H3,(H,24,26).
What are the key properties of 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine?
4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine has a molecular weight of 357.46 g/mol, XLogP of 4.73, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[5-(2-butyl-1H-imidazol-5-yl)-4-phenylimidazol-1-yl]methyl]pyridine is sourced from PubChem (CID 50963775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).