4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine

C16H32N2O — CID 118879977

IUPAC4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine
SMILESCC(C)CC1CCN(CCCN2CCOCC2)CC1
InChIInChI=1S/C16H32N2O/c1-15(2)14-16-4-8-17(9-5-16)6-3-7-18-10-12-19-13-11-18/h15-16H,3-14H2,1-2H3
InChIKeyDIOVXUCONYBWGN-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.47
Rot. Bonds6

About 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine

4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine (PubChem CID 118879977) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine.

Molecular Properties

Compound Name4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine
PubChem CID118879977
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine
SMILESCC(C)CC1CCN(CCCN2CCOCC2)CC1
InChIInChI=1S/C16H32N2O/c1-15(2)14-16-4-8-17(9-5-16)6-3-7-18-10-12-19-13-11-18/h15-16H,3-14H2,1-2H3
InChIKeyDIOVXUCONYBWGN-UHFFFAOYSA-N
XLogP2.47
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine?
The IUPAC name of 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine (CID 118879977) is 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine.
What is the SMILES notation for 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine?
The canonical SMILES for 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine is CC(C)CC1CCN(CCCN2CCOCC2)CC1.
What is the InChIKey of 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine?
The InChIKey is DIOVXUCONYBWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-15(2)14-16-4-8-17(9-5-16)6-3-7-18-10-12-19-13-11-18/h15-16H,3-14H2,1-2H3.
What are the key properties of 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine?
4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine has a molecular weight of 268.44 g/mol, XLogP of 2.47, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[4-(2-methylpropyl)piperidin-1-yl]propyl]morpholine is sourced from PubChem (CID 118879977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).