2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one

C15H28N2O2 — CID 42849216

IUPAC2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one
SMILESCC1CCN(CC2CN(C(=O)C(C)C)CCO2)CC1
InChIInChI=1S/C15H28N2O2/c1-12(2)15(18)17-8-9-19-14(11-17)10-16-6-4-13(3)5-7-16/h12-14H,4-11H2,1-3H3
InChIKeyJMWJMOAYWHVBOB-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.60
Rot. Bonds3

About 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one

2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one (PubChem CID 42849216) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one
PubChem CID42849216
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one
SMILESCC1CCN(CC2CN(C(=O)C(C)C)CCO2)CC1
InChIInChI=1S/C15H28N2O2/c1-12(2)15(18)17-8-9-19-14(11-17)10-16-6-4-13(3)5-7-16/h12-14H,4-11H2,1-3H3
InChIKeyJMWJMOAYWHVBOB-UHFFFAOYSA-N
XLogP1.60
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-1-[(2S)-2-(methylaminomethyl)morpholin-4-yl]propan-1-one
CID 139553521
2-methyl-1-[(2R)-2-(4-methylpentyl)morpholin-4-yl]propan-1-one
CID 95225161
methane;2-methyl-1-(4-methylpiperidin-1-yl)propan-1-one
CID 143298111
2-[4-(4-methylpiperidine-1-carbonyl)morpholin-2-yl]acetic acid
CID 66435209
4-methyl-1-[[(2R)-oxiran-2-yl]methyl]piperidine
CID 40505250
methyl 1-[(4-propan-2-ylmorpholin-2-yl)methyl]piperidine-4-carboxylate
CID 64533750
1-[2-(aminomethyl)morpholin-4-yl]-2,2-difluoroethanone
CID 103840827
1-[(4-methylmorpholin-2-yl)methyl]piperidine-4-carboxylic acid
CID 79182775
2-[4-[(2S)-2-aminopropanoyl]morpholin-2-yl]acetic acid
CID 66433437
1-[(4-propan-2-ylmorpholin-2-yl)methyl]pyrrolidine-3-carboxylic acid
CID 64532739
(2R)-1-[(2S)-2-ethylmorpholin-4-yl]-2-methylsulfonylpropan-1-one
CID 95153981
(2R)-2-amino-1-[2-(pyrazol-1-ylmethyl)morpholin-4-yl]propan-1-one
CID 119880996

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one?
The IUPAC name of 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one (CID 42849216) is 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one.
What is the SMILES notation for 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one?
The canonical SMILES for 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one is CC1CCN(CC2CN(C(=O)C(C)C)CCO2)CC1.
What is the InChIKey of 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one?
The InChIKey is JMWJMOAYWHVBOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-12(2)15(18)17-8-9-19-14(11-17)10-16-6-4-13(3)5-7-16/h12-14H,4-11H2,1-3H3.
What are the key properties of 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one?
2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one has a molecular weight of 268.40 g/mol, XLogP of 1.60, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[2-[(4-methylpiperidin-1-yl)methyl]morpholin-4-yl]propan-1-one is sourced from PubChem (CID 42849216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).