5-methyl-2-(3-methylpentyl)piperidine

C12H25N — CID 112556928

IUPAC5-methyl-2-(3-methylpentyl)piperidine
SMILESCCC(C)CCC1CCC(C)CN1
InChIInChI=1S/C12H25N/c1-4-10(2)5-7-12-8-6-11(3)9-13-12/h10-13H,4-9H2,1-3H3
InChIKeyWWQUKXBSCYQZTA-UHFFFAOYSA-N
MW183.34 g/mol
LogP3.20
Rot. Bonds4

About 5-methyl-2-(3-methylpentyl)piperidine

5-methyl-2-(3-methylpentyl)piperidine (PubChem CID 112556928) has the molecular formula C12H25N and a molecular weight of 183.34 g/mol. Its IUPAC name is 5-methyl-2-(3-methylpentyl)piperidine.

Molecular Properties

Compound Name5-methyl-2-(3-methylpentyl)piperidine
PubChem CID112556928
Molecular FormulaC12H25N
Molecular Weight183.34 g/mol
Exact Mass183.20
IUPAC Name5-methyl-2-(3-methylpentyl)piperidine
SMILESCCC(C)CCC1CCC(C)CN1
InChIInChI=1S/C12H25N/c1-4-10(2)5-7-12-8-6-11(3)9-13-12/h10-13H,4-9H2,1-3H3
InChIKeyWWQUKXBSCYQZTA-UHFFFAOYSA-N
XLogP3.20
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.34
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-methylpentyl)piperidine?
The IUPAC name of 5-methyl-2-(3-methylpentyl)piperidine (CID 112556928) is 5-methyl-2-(3-methylpentyl)piperidine.
What is the SMILES notation for 5-methyl-2-(3-methylpentyl)piperidine?
The canonical SMILES for 5-methyl-2-(3-methylpentyl)piperidine is CCC(C)CCC1CCC(C)CN1.
What is the InChIKey of 5-methyl-2-(3-methylpentyl)piperidine?
The InChIKey is WWQUKXBSCYQZTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N/c1-4-10(2)5-7-12-8-6-11(3)9-13-12/h10-13H,4-9H2,1-3H3.
What are the key properties of 5-methyl-2-(3-methylpentyl)piperidine?
5-methyl-2-(3-methylpentyl)piperidine has a molecular weight of 183.34 g/mol, XLogP of 3.20, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-methylpentyl)piperidine is sourced from PubChem (CID 112556928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).