4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine

C20H21N3 — CID 177339626

IUPAC4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine
SMILESc1ccc(-c2nc(C3CCNCC3)[nH]c2-c2ccccc2)cc1
InChIInChI=1S/C20H21N3/c1-3-7-15(8-4-1)18-19(16-9-5-2-6-10-16)23-20(22-18)17-11-13-21-14-12-17/h1-10,17,21H,11-14H2,(H,22,23)
InChIKeyOTBJAPSNVSQEEY-UHFFFAOYSA-N
MW303.41 g/mol
LogP4.21
Rot. Bonds3

About 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine

4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine (PubChem CID 177339626) has the molecular formula C20H21N3 and a molecular weight of 303.41 g/mol. Its IUPAC name is 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine.

Molecular Properties

Compound Name4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine
PubChem CID177339626
Molecular FormulaC20H21N3
Molecular Weight303.41 g/mol
Exact Mass303.17
IUPAC Name4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine
SMILESc1ccc(-c2nc(C3CCNCC3)[nH]c2-c2ccccc2)cc1
InChIInChI=1S/C20H21N3/c1-3-7-15(8-4-1)18-19(16-9-5-2-6-10-16)23-20(22-18)17-11-13-21-14-12-17/h1-10,17,21H,11-14H2,(H,22,23)
InChIKeyOTBJAPSNVSQEEY-UHFFFAOYSA-N
XLogP4.21
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine?
The IUPAC name of 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine (CID 177339626) is 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine.
What is the SMILES notation for 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine?
The canonical SMILES for 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine is c1ccc(-c2nc(C3CCNCC3)[nH]c2-c2ccccc2)cc1.
What is the InChIKey of 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine?
The InChIKey is OTBJAPSNVSQEEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3/c1-3-7-15(8-4-1)18-19(16-9-5-2-6-10-16)23-20(22-18)17-11-13-21-14-12-17/h1-10,17,21H,11-14H2,(H,22,23).
What are the key properties of 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine?
4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine has a molecular weight of 303.41 g/mol, XLogP of 4.21, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4,5-diphenyl-1H-imidazol-2-yl)piperidine is sourced from PubChem (CID 177339626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).