3-(5-methyl-2-phenylimidazol-1-yl)piperidine

C15H19N3 — CID 90488061

IUPAC3-(5-methyl-2-phenylimidazol-1-yl)piperidine
SMILESCc1cnc(-c2ccccc2)n1C1CCCNC1
InChIInChI=1S/C15H19N3/c1-12-10-17-15(13-6-3-2-4-7-13)18(12)14-8-5-9-16-11-14/h2-4,6-7,10,14,16H,5,8-9,11H2,1H3
InChIKeyHLMRVAUIUXLXQG-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.78
Rot. Bonds2

About 3-(5-methyl-2-phenylimidazol-1-yl)piperidine

3-(5-methyl-2-phenylimidazol-1-yl)piperidine (PubChem CID 90488061) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is 3-(5-methyl-2-phenylimidazol-1-yl)piperidine.

Molecular Properties

Compound Name3-(5-methyl-2-phenylimidazol-1-yl)piperidine
PubChem CID90488061
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC Name3-(5-methyl-2-phenylimidazol-1-yl)piperidine
SMILESCc1cnc(-c2ccccc2)n1C1CCCNC1
InChIInChI=1S/C15H19N3/c1-12-10-17-15(13-6-3-2-4-7-13)18(12)14-8-5-9-16-11-14/h2-4,6-7,10,14,16H,5,8-9,11H2,1H3
InChIKeyHLMRVAUIUXLXQG-UHFFFAOYSA-N
XLogP2.78
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The IUPAC name of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine (CID 90488061) is 3-(5-methyl-2-phenylimidazol-1-yl)piperidine.
What is the SMILES notation for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The canonical SMILES for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine is Cc1cnc(-c2ccccc2)n1C1CCCNC1.
What is the InChIKey of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
The InChIKey is HLMRVAUIUXLXQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-12-10-17-15(13-6-3-2-4-7-13)18(12)14-8-5-9-16-11-14/h2-4,6-7,10,14,16H,5,8-9,11H2,1H3.
What are the key properties of 3-(5-methyl-2-phenylimidazol-1-yl)piperidine?
3-(5-methyl-2-phenylimidazol-1-yl)piperidine has a molecular weight of 241.34 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-2-phenylimidazol-1-yl)piperidine is sourced from PubChem (CID 90488061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).