1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine

C14H28N2 — CID 63129487

IUPAC1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
SMILESCCC1(CN2CCC(C)CC2)CCNCC1
InChIInChI=1S/C14H28N2/c1-3-14(6-8-15-9-7-14)12-16-10-4-13(2)5-11-16/h13,15H,3-12H2,1-2H3
InChIKeyGKQDKBCKBOIMSM-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.50
Rot. Bonds3

About 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine

1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine (PubChem CID 63129487) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine.

Molecular Properties

Compound Name1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
PubChem CID63129487
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine
SMILESCCC1(CN2CCC(C)CC2)CCNCC1
InChIInChI=1S/C14H28N2/c1-3-14(6-8-15-9-7-14)12-16-10-4-13(2)5-11-16/h13,15H,3-12H2,1-2H3
InChIKeyGKQDKBCKBOIMSM-UHFFFAOYSA-N
XLogP2.50
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine?
The IUPAC name of 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine (CID 63129487) is 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine.
What is the SMILES notation for 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine?
The canonical SMILES for 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine is CCC1(CN2CCC(C)CC2)CCNCC1.
What is the InChIKey of 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine?
The InChIKey is GKQDKBCKBOIMSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-3-14(6-8-15-9-7-14)12-16-10-4-13(2)5-11-16/h13,15H,3-12H2,1-2H3.
What are the key properties of 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine?
1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine has a molecular weight of 224.39 g/mol, XLogP of 2.50, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-ethylpiperidin-4-yl)methyl]-4-methylpiperidine is sourced from PubChem (CID 63129487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).