1-methylpiperidine;1,2,4,5-tetramethylimidazole

C13H25N3 — CID 142002104

IUPAC1-methylpiperidine;1,2,4,5-tetramethylimidazole
SMILESCN1CCCCC1.Cc1nc(C)n(C)c1C
InChIInChI=1S/C7H12N2.C6H13N/c1-5-6(2)9(4)7(3)8-5;1-7-5-3-2-4-6-7/h1-4H3;2-6H2,1H3
InChIKeyYYIIIERFRYJFGR-UHFFFAOYSA-N
MW223.36 g/mol
LogP2.45
Rot. Bonds

About 1-methylpiperidine;1,2,4,5-tetramethylimidazole

1-methylpiperidine;1,2,4,5-tetramethylimidazole (PubChem CID 142002104) has the molecular formula C13H25N3 and a molecular weight of 223.36 g/mol. Its IUPAC name is 1-methylpiperidine;1,2,4,5-tetramethylimidazole.

Molecular Properties

Compound Name1-methylpiperidine;1,2,4,5-tetramethylimidazole
PubChem CID142002104
Molecular FormulaC13H25N3
Molecular Weight223.36 g/mol
Exact Mass223.20
IUPAC Name1-methylpiperidine;1,2,4,5-tetramethylimidazole
SMILESCN1CCCCC1.Cc1nc(C)n(C)c1C
InChIInChI=1S/C7H12N2.C6H13N/c1-5-6(2)9(4)7(3)8-5;1-7-5-3-2-4-6-7/h1-4H3;2-6H2,1H3
InChIKeyYYIIIERFRYJFGR-UHFFFAOYSA-N
XLogP2.45
TPSA21.06 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.36
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methylpiperidine;1,2,4,5-tetramethylimidazole?
The IUPAC name of 1-methylpiperidine;1,2,4,5-tetramethylimidazole (CID 142002104) is 1-methylpiperidine;1,2,4,5-tetramethylimidazole.
What is the SMILES notation for 1-methylpiperidine;1,2,4,5-tetramethylimidazole?
The canonical SMILES for 1-methylpiperidine;1,2,4,5-tetramethylimidazole is CN1CCCCC1.Cc1nc(C)n(C)c1C.
What is the InChIKey of 1-methylpiperidine;1,2,4,5-tetramethylimidazole?
The InChIKey is YYIIIERFRYJFGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2.C6H13N/c1-5-6(2)9(4)7(3)8-5;1-7-5-3-2-4-6-7/h1-4H3;2-6H2,1H3.
What are the key properties of 1-methylpiperidine;1,2,4,5-tetramethylimidazole?
1-methylpiperidine;1,2,4,5-tetramethylimidazole has a molecular weight of 223.36 g/mol, XLogP of 2.45, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methylpiperidine;1,2,4,5-tetramethylimidazole is sourced from PubChem (CID 142002104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).