1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine

C17H34N2O — CID 167417336

IUPAC1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine
SMILESCC(C)OC1CCN(CC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C17H34N2O/c1-14(2)19-11-5-16(6-12-19)13-18-9-7-17(8-10-18)20-15(3)4/h14-17H,5-13H2,1-4H3
InChIKeyOOSUSXIKMDAUAW-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.00
Rot. Bonds5

About 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine

1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine (PubChem CID 167417336) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine.

Molecular Properties

Compound Name1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine
PubChem CID167417336
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine
SMILESCC(C)OC1CCN(CC2CCN(C(C)C)CC2)CC1
InChIInChI=1S/C17H34N2O/c1-14(2)19-11-5-16(6-12-19)13-18-9-7-17(8-10-18)20-15(3)4/h14-17H,5-13H2,1-4H3
InChIKeyOOSUSXIKMDAUAW-UHFFFAOYSA-N
XLogP3.00
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine?
The IUPAC name of 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine (CID 167417336) is 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine.
What is the SMILES notation for 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine?
The canonical SMILES for 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine is CC(C)OC1CCN(CC2CCN(C(C)C)CC2)CC1.
What is the InChIKey of 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine?
The InChIKey is OOSUSXIKMDAUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-14(2)19-11-5-16(6-12-19)13-18-9-7-17(8-10-18)20-15(3)4/h14-17H,5-13H2,1-4H3.
What are the key properties of 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine?
1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine has a molecular weight of 282.47 g/mol, XLogP of 3.00, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4-[(4-propan-2-yloxypiperidin-1-yl)methyl]piperidine is sourced from PubChem (CID 167417336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).