3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine

C13H26N2O — CID 66580909

IUPAC3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine
SMILESCC1COCCN1CCN1CCC[C@@H](C)C1
InChIInChI=1S/C13H26N2O/c1-12-4-3-5-14(10-12)6-7-15-8-9-16-11-13(15)2/h12-13H,3-11H2,1-2H3/t12-,13?/m1/s1
InChIKeyTWDUTACWVJYCHY-PZORYLMUSA-N
MW226.36 g/mol
LogP1.44
Rot. Bonds3

About 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine

3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine (PubChem CID 66580909) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine.

Molecular Properties

Compound Name3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine
PubChem CID66580909
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine
SMILESCC1COCCN1CCN1CCC[C@@H](C)C1
InChIInChI=1S/C13H26N2O/c1-12-4-3-5-14(10-12)6-7-15-8-9-16-11-13(15)2/h12-13H,3-11H2,1-2H3/t12-,13?/m1/s1
InChIKeyTWDUTACWVJYCHY-PZORYLMUSA-N
XLogP1.44
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine?
The IUPAC name of 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine (CID 66580909) is 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine.
What is the SMILES notation for 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine?
The canonical SMILES for 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine is CC1COCCN1CCN1CCC[C@@H](C)C1.
What is the InChIKey of 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine?
The InChIKey is TWDUTACWVJYCHY-PZORYLMUSA-N. The full InChI is InChI=1S/C13H26N2O/c1-12-4-3-5-14(10-12)6-7-15-8-9-16-11-13(15)2/h12-13H,3-11H2,1-2H3/t12-,13?/m1/s1.
What are the key properties of 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine?
3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine has a molecular weight of 226.36 g/mol, XLogP of 1.44, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-4-[2-[(3R)-3-methylpiperidin-1-yl]ethyl]morpholine is sourced from PubChem (CID 66580909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).