1-methyl-4-(4-propoxypiperidin-1-yl)piperidine

C14H28N2O — CID 169029222

IUPAC1-methyl-4-(4-propoxypiperidin-1-yl)piperidine
SMILESCCCOC1CCN(C2CCN(C)CC2)CC1
InChIInChI=1S/C14H28N2O/c1-3-12-17-14-6-10-16(11-7-14)13-4-8-15(2)9-5-13/h13-14H,3-12H2,1-2H3
InChIKeyBFYRJALIEBFXPZ-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.97
Rot. Bonds4

About 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine

1-methyl-4-(4-propoxypiperidin-1-yl)piperidine (PubChem CID 169029222) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine.

Molecular Properties

Compound Name1-methyl-4-(4-propoxypiperidin-1-yl)piperidine
PubChem CID169029222
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name1-methyl-4-(4-propoxypiperidin-1-yl)piperidine
SMILESCCCOC1CCN(C2CCN(C)CC2)CC1
InChIInChI=1S/C14H28N2O/c1-3-12-17-14-6-10-16(11-7-14)13-4-8-15(2)9-5-13/h13-14H,3-12H2,1-2H3
InChIKeyBFYRJALIEBFXPZ-UHFFFAOYSA-N
XLogP1.97
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine?
The IUPAC name of 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine (CID 169029222) is 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine.
What is the SMILES notation for 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine?
The canonical SMILES for 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine is CCCOC1CCN(C2CCN(C)CC2)CC1.
What is the InChIKey of 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine?
The InChIKey is BFYRJALIEBFXPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-12-17-14-6-10-16(11-7-14)13-4-8-15(2)9-5-13/h13-14H,3-12H2,1-2H3.
What are the key properties of 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine?
1-methyl-4-(4-propoxypiperidin-1-yl)piperidine has a molecular weight of 240.39 g/mol, XLogP of 1.97, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-propoxypiperidin-1-yl)piperidine is sourced from PubChem (CID 169029222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).