1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine

C15H30N2 — CID 114431246

IUPAC1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine
SMILESCCC1CCNC(CN2CC(C)CCC2C)C1
InChIInChI=1S/C15H30N2/c1-4-14-7-8-16-15(9-14)11-17-10-12(2)5-6-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyQAQULVJFCVELMC-UHFFFAOYSA-N
MW238.42 g/mol
LogP2.88
Rot. Bonds3

About 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine

1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine (PubChem CID 114431246) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine.

Molecular Properties

Compound Name1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine
PubChem CID114431246
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine
SMILESCCC1CCNC(CN2CC(C)CCC2C)C1
InChIInChI=1S/C15H30N2/c1-4-14-7-8-16-15(9-14)11-17-10-12(2)5-6-13(17)3/h12-16H,4-11H2,1-3H3
InChIKeyQAQULVJFCVELMC-UHFFFAOYSA-N
XLogP2.88
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine?
The IUPAC name of 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine (CID 114431246) is 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine.
What is the SMILES notation for 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine?
The canonical SMILES for 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine is CCC1CCNC(CN2CC(C)CCC2C)C1.
What is the InChIKey of 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine?
The InChIKey is QAQULVJFCVELMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-14-7-8-16-15(9-14)11-17-10-12(2)5-6-13(17)3/h12-16H,4-11H2,1-3H3.
What are the key properties of 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine?
1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine has a molecular weight of 238.42 g/mol, XLogP of 2.88, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylpiperidin-2-yl)methyl]-2,5-dimethylpiperidine is sourced from PubChem (CID 114431246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).