2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine

C15H25N3 — CID 114720496

IUPAC2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
SMILESCC1CCCC(c2cncn2C2CCCC2C)N1
InChIInChI=1S/C15H25N3/c1-11-5-3-8-14(11)18-10-16-9-15(18)13-7-4-6-12(2)17-13/h9-14,17H,3-8H2,1-2H3
InChIKeySAZUGBASUOXFEL-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.45
Rot. Bonds2

About 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine

2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine (PubChem CID 114720496) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine.

Molecular Properties

Compound Name2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
PubChem CID114720496
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
SMILESCC1CCCC(c2cncn2C2CCCC2C)N1
InChIInChI=1S/C15H25N3/c1-11-5-3-8-14(11)18-10-16-9-15(18)13-7-4-6-12(2)17-13/h9-14,17H,3-8H2,1-2H3
InChIKeySAZUGBASUOXFEL-UHFFFAOYSA-N
XLogP3.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine?
The IUPAC name of 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine (CID 114720496) is 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine.
What is the SMILES notation for 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine?
The canonical SMILES for 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine is CC1CCCC(c2cncn2C2CCCC2C)N1.
What is the InChIKey of 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine?
The InChIKey is SAZUGBASUOXFEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-11-5-3-8-14(11)18-10-16-9-15(18)13-7-4-6-12(2)17-13/h9-14,17H,3-8H2,1-2H3.
What are the key properties of 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine?
2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine has a molecular weight of 247.39 g/mol, XLogP of 3.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine is sourced from PubChem (CID 114720496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).