2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine

C14H25N3 — CID 114716663

IUPAC2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine
SMILESCCCC(C)n1cncc1C1CCCC(C)N1
InChIInChI=1S/C14H25N3/c1-4-6-12(3)17-10-15-9-14(17)13-8-5-7-11(2)16-13/h9-13,16H,4-8H2,1-3H3
InChIKeyMVXHUEUIYHMUKN-UHFFFAOYSA-N
MW235.37 g/mol
LogP3.45
Rot. Bonds4

About 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine

2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine (PubChem CID 114716663) has the molecular formula C14H25N3 and a molecular weight of 235.37 g/mol. Its IUPAC name is 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine.

Molecular Properties

Compound Name2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine
PubChem CID114716663
Molecular FormulaC14H25N3
Molecular Weight235.37 g/mol
Exact Mass235.20
IUPAC Name2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine
SMILESCCCC(C)n1cncc1C1CCCC(C)N1
InChIInChI=1S/C14H25N3/c1-4-6-12(3)17-10-15-9-14(17)13-8-5-7-11(2)16-13/h9-13,16H,4-8H2,1-3H3
InChIKeyMVXHUEUIYHMUKN-UHFFFAOYSA-N
XLogP3.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.37
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-6-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
CID 114719364
2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine
CID 114719576
2-methyl-6-[3-(3-methylbutyl)imidazol-4-yl]piperidine
CID 114716386
2-[3-(2,2-difluoroethyl)imidazol-4-yl]-6-methylpiperidine
CID 114721475
1-hexan-2-yl-5-pyrrolidin-2-ylimidazole
CID 114705557
1-heptan-2-yl-5-pyrrolidin-2-ylimidazole
CID 114705341
2-methyl-6-[3-[1-(2-methylphenyl)ethyl]imidazol-4-yl]piperidine
CID 114719209
5-cyclopropyl-1-heptan-2-ylimidazole
CID 116811645
2-[3-[1-(3-chlorophenyl)ethyl]imidazol-4-yl]-6-methylpiperidine
CID 114719041
2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
CID 114720496
2-methyl-6-[3-(2-propylphenyl)imidazol-4-yl]piperidine
CID 114719236
2-methyl-6-[3-(2-methylcyclohexyl)imidazol-4-yl]piperidine
CID 114717087

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine?
The IUPAC name of 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine (CID 114716663) is 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine.
What is the SMILES notation for 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine?
The canonical SMILES for 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine is CCCC(C)n1cncc1C1CCCC(C)N1.
What is the InChIKey of 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine?
The InChIKey is MVXHUEUIYHMUKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3/c1-4-6-12(3)17-10-15-9-14(17)13-8-5-7-11(2)16-13/h9-13,16H,4-8H2,1-3H3.
What are the key properties of 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine?
2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine has a molecular weight of 235.37 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine is sourced from PubChem (CID 114716663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).