2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine

C16H25N3 — CID 114719576

IUPAC2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine
SMILESCC1CCCC(c2cncn2C(C2CC2)C2CC2)N1
InChIInChI=1S/C16H25N3/c1-11-3-2-4-14(18-11)15-9-17-10-19(15)16(12-5-6-12)13-7-8-13/h9-14,16,18H,2-8H2,1H3
InChIKeyJPPQEGLOOIUGJU-UHFFFAOYSA-N
MW259.40 g/mol
LogP3.45
Rot. Bonds4

About 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine

2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine (PubChem CID 114719576) has the molecular formula C16H25N3 and a molecular weight of 259.40 g/mol. Its IUPAC name is 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine.

Molecular Properties

Compound Name2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine
PubChem CID114719576
Molecular FormulaC16H25N3
Molecular Weight259.40 g/mol
Exact Mass259.20
IUPAC Name2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine
SMILESCC1CCCC(c2cncn2C(C2CC2)C2CC2)N1
InChIInChI=1S/C16H25N3/c1-11-3-2-4-14(18-11)15-9-17-10-19(15)16(12-5-6-12)13-7-8-13/h9-14,16,18H,2-8H2,1H3
InChIKeyJPPQEGLOOIUGJU-UHFFFAOYSA-N
XLogP3.45
TPSA29.85 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-6-(3-pentan-2-ylimidazol-4-yl)piperidine
CID 114716663
2-[3-(2,2-difluoroethyl)imidazol-4-yl]-6-methylpiperidine
CID 114721475
2-methyl-6-[3-(1-pyrrolidin-1-ylpropan-2-yl)imidazol-4-yl]piperidine
CID 114719364
2-methyl-6-[3-[1-(2-methylphenyl)ethyl]imidazol-4-yl]piperidine
CID 114719209
2-methyl-6-[3-(2-methylcyclopentyl)imidazol-4-yl]piperidine
CID 114720496
2-methyl-6-[3-(2-methylcyclohexyl)imidazol-4-yl]piperidine
CID 114717087
2-methyl-6-[3-(3-methylbutyl)imidazol-4-yl]piperidine
CID 114716386
2-[3-[1-(3-chlorophenyl)ethyl]imidazol-4-yl]-6-methylpiperidine
CID 114719041
2-[3-(2,2-dimethylcyclohexyl)imidazol-4-yl]-6-methylpiperidine
CID 114721223
2-methyl-6-[3-(1-methylpyrazol-4-yl)imidazol-4-yl]piperidine
CID 114717939
2-methyl-6-[3-(oxan-4-ylmethyl)imidazol-4-yl]piperidine
CID 114720357
2-methyl-6-[3-(4-methyloxan-4-yl)imidazol-4-yl]piperidine
CID 114722066

Frequently Asked Questions

What is the IUPAC name of 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine?
The IUPAC name of 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine (CID 114719576) is 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine.
What is the SMILES notation for 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine?
The canonical SMILES for 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine is CC1CCCC(c2cncn2C(C2CC2)C2CC2)N1.
What is the InChIKey of 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine?
The InChIKey is JPPQEGLOOIUGJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25N3/c1-11-3-2-4-14(18-11)15-9-17-10-19(15)16(12-5-6-12)13-7-8-13/h9-14,16,18H,2-8H2,1H3.
What are the key properties of 2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine?
2-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine has a molecular weight of 259.40 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-[3-(dicyclopropylmethyl)imidazol-4-yl]-6-methylpiperidine is sourced from PubChem (CID 114719576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).