1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine

C15H26N4 — CID 114704727

IUPAC1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine
SMILESCN1CCCC(Cn2cncc2C2CCCCN2)C1
InChIInChI=1S/C15H26N4/c1-18-8-4-5-13(10-18)11-19-12-16-9-15(19)14-6-2-3-7-17-14/h9,12-14,17H,2-8,10-11H2,1H3
InChIKeyTUFBFWFEAZANTG-UHFFFAOYSA-N
MW262.40 g/mol
LogP2.04
Rot. Bonds3

About 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine

1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine (PubChem CID 114704727) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine.

Molecular Properties

Compound Name1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine
PubChem CID114704727
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine
SMILESCN1CCCC(Cn2cncc2C2CCCCN2)C1
InChIInChI=1S/C15H26N4/c1-18-8-4-5-13(10-18)11-19-12-16-9-15(19)14-6-2-3-7-17-14/h9,12-14,17H,2-8,10-11H2,1H3
InChIKeyTUFBFWFEAZANTG-UHFFFAOYSA-N
XLogP2.04
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1,4-dimethyl-4-[(5-pyrrolidin-2-ylimidazol-1-yl)methyl]piperidine
CID 107165724
1-ethyl-5-pyrrolidin-2-ylimidazole
CID 66134082
2-[3-(3-methoxypropyl)imidazol-4-yl]piperidine
CID 114703963
1-[(2-methylcyclopentyl)methyl]-5-pyrrolidin-2-ylimidazole
CID 107421507
2-[3-(2-methylbutyl)imidazol-4-yl]piperidine
CID 114705654
1-(4-methylpentyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104943065
1,4-dimethyl-2-[[5-(6-methylpiperidin-2-yl)imidazol-1-yl]methyl]piperazine
CID 114720756
2-[3-(4,4,4-trifluorobutyl)imidazol-4-yl]piperidine
CID 114707003
2-[3-[2-(2-methylphenyl)ethyl]imidazol-4-yl]piperidine
CID 114706613
1-(2-methylsulfonylethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104942355
1-(2-ethoxyethyl)-5-[(2S)-pyrrolidin-2-yl]imidazole
CID 104941455
1-piperidin-1-yl-2-(5-piperidin-2-ylimidazol-1-yl)ethanone
CID 114707098

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine?
The IUPAC name of 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine (CID 114704727) is 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine.
What is the SMILES notation for 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine?
The canonical SMILES for 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine is CN1CCCC(Cn2cncc2C2CCCCN2)C1.
What is the InChIKey of 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine?
The InChIKey is TUFBFWFEAZANTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4/c1-18-8-4-5-13(10-18)11-19-12-16-9-15(19)14-6-2-3-7-17-14/h9,12-14,17H,2-8,10-11H2,1H3.
What are the key properties of 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine?
1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine has a molecular weight of 262.40 g/mol, XLogP of 2.04, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(5-piperidin-2-ylimidazol-1-yl)methyl]piperidine is sourced from PubChem (CID 114704727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).