2,5-dimethylpiperidine

C7H15N — CID 524018

IUPAC2,5-dimethylpiperidine
SMILESCC1CCC(C)NC1
InChIInChI=1S/C7H15N/c1-6-3-4-7(2)8-5-6/h6-8H,3-5H2,1-2H3
InChIKeyICBFNPPCXPMCBP-UHFFFAOYSA-N
MW113.20 g/mol
LogP1.39
Rot. Bonds

About 2,5-dimethylpiperidine

2,5-dimethylpiperidine (PubChem CID 524018) has the molecular formula C7H15N and a molecular weight of 113.20 g/mol. Its IUPAC name is 2,5-dimethylpiperidine.

Molecular Properties

Compound Name2,5-dimethylpiperidine
PubChem CID524018
Molecular FormulaC7H15N
Molecular Weight113.20 g/mol
Exact Mass113.12
IUPAC Name2,5-dimethylpiperidine
SMILESCC1CCC(C)NC1
InChIInChI=1S/C7H15N/c1-6-3-4-7(2)8-5-6/h6-8H,3-5H2,1-2H3
InChIKeyICBFNPPCXPMCBP-UHFFFAOYSA-N
XLogP1.39
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.20
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpiperidine?
The IUPAC name of 2,5-dimethylpiperidine (CID 524018) is 2,5-dimethylpiperidine.
What is the SMILES notation for 2,5-dimethylpiperidine?
The canonical SMILES for 2,5-dimethylpiperidine is CC1CCC(C)NC1.
What is the InChIKey of 2,5-dimethylpiperidine?
The InChIKey is ICBFNPPCXPMCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N/c1-6-3-4-7(2)8-5-6/h6-8H,3-5H2,1-2H3.
What are the key properties of 2,5-dimethylpiperidine?
2,5-dimethylpiperidine has a molecular weight of 113.20 g/mol, XLogP of 1.39, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethylpiperidine is sourced from PubChem (CID 524018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).