3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine

C16H34N2 — CID 63159907

IUPAC3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
SMILESCCC1(C)CCN(CC(C)(C)CNC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-7-16(6)8-10-18(11-9-16)13-15(4,5)12-17-14(2)3/h14,17H,7-13H2,1-6H3
InChIKeyKPRXMKOEGYLLIQ-UHFFFAOYSA-N
MW254.46 g/mol
LogP3.52
Rot. Bonds6

About 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine

3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine (PubChem CID 63159907) has the molecular formula C16H34N2 and a molecular weight of 254.46 g/mol. Its IUPAC name is 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
PubChem CID63159907
Molecular FormulaC16H34N2
Molecular Weight254.46 g/mol
Exact Mass254.27
IUPAC Name3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine
SMILESCCC1(C)CCN(CC(C)(C)CNC(C)C)CC1
InChIInChI=1S/C16H34N2/c1-7-16(6)8-10-18(11-9-16)13-15(4,5)12-17-14(2)3/h14,17H,7-13H2,1-6H3
InChIKeyKPRXMKOEGYLLIQ-UHFFFAOYSA-N
XLogP3.52
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.46
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine?
The IUPAC name of 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine (CID 63159907) is 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine is CCC1(C)CCN(CC(C)(C)CNC(C)C)CC1.
What is the InChIKey of 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine?
The InChIKey is KPRXMKOEGYLLIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H34N2/c1-7-16(6)8-10-18(11-9-16)13-15(4,5)12-17-14(2)3/h14,17H,7-13H2,1-6H3.
What are the key properties of 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine?
3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine has a molecular weight of 254.46 g/mol, XLogP of 3.52, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethyl-4-methylpiperidin-1-yl)-2,2-dimethyl-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 63159907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).