2-(4-methylpentyl)piperidine

C11H23N — CID 16638154

IUPAC2-(4-methylpentyl)piperidine
SMILESCC(C)CCCC1CCCCN1
InChIInChI=1S/C11H23N/c1-10(2)6-5-8-11-7-3-4-9-12-11/h10-12H,3-9H2,1-2H3
InChIKeyOVXGRFZPXYVMEZ-UHFFFAOYSA-N
MW169.31 g/mol
LogP2.95
Rot. Bonds4

About 2-(4-methylpentyl)piperidine

2-(4-methylpentyl)piperidine (PubChem CID 16638154) has the molecular formula C11H23N and a molecular weight of 169.31 g/mol. Its IUPAC name is 2-(4-methylpentyl)piperidine.

Molecular Properties

Compound Name2-(4-methylpentyl)piperidine
PubChem CID16638154
Molecular FormulaC11H23N
Molecular Weight169.31 g/mol
Exact Mass169.18
IUPAC Name2-(4-methylpentyl)piperidine
SMILESCC(C)CCCC1CCCCN1
InChIInChI=1S/C11H23N/c1-10(2)6-5-8-11-7-3-4-9-12-11/h10-12H,3-9H2,1-2H3
InChIKeyOVXGRFZPXYVMEZ-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.31
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpentyl)piperidine?
The IUPAC name of 2-(4-methylpentyl)piperidine (CID 16638154) is 2-(4-methylpentyl)piperidine.
What is the SMILES notation for 2-(4-methylpentyl)piperidine?
The canonical SMILES for 2-(4-methylpentyl)piperidine is CC(C)CCCC1CCCCN1.
What is the InChIKey of 2-(4-methylpentyl)piperidine?
The InChIKey is OVXGRFZPXYVMEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N/c1-10(2)6-5-8-11-7-3-4-9-12-11/h10-12H,3-9H2,1-2H3.
What are the key properties of 2-(4-methylpentyl)piperidine?
2-(4-methylpentyl)piperidine has a molecular weight of 169.31 g/mol, XLogP of 2.95, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpentyl)piperidine is sourced from PubChem (CID 16638154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).