2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one

C14H24N2O3 — CID 42935955

IUPAC2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
SMILESCC(C)C(=O)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O3/c1-11(2)13(17)16-5-3-4-12(10-16)14(18)15-6-8-19-9-7-15/h11-12H,3-10H2,1-2H3
InChIKeyVDDASYJDMWGOBG-UHFFFAOYSA-N
MW268.36 g/mol
LogP0.74
Rot. Bonds2

About 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one

2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one (PubChem CID 42935955) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one.

Molecular Properties

Compound Name2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
PubChem CID42935955
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Name2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one
SMILESCC(C)C(=O)N1CCCC(C(=O)N2CCOCC2)C1
InChIInChI=1S/C14H24N2O3/c1-11(2)13(17)16-5-3-4-12(10-16)14(18)15-6-8-19-9-7-15/h11-12H,3-10H2,1-2H3
InChIKeyVDDASYJDMWGOBG-UHFFFAOYSA-N
XLogP0.74
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 50.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The IUPAC name of 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one (CID 42935955) is 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one.
What is the SMILES notation for 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The canonical SMILES for 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one is CC(C)C(=O)N1CCCC(C(=O)N2CCOCC2)C1.
What is the InChIKey of 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
The InChIKey is VDDASYJDMWGOBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-11(2)13(17)16-5-3-4-12(10-16)14(18)15-6-8-19-9-7-15/h11-12H,3-10H2,1-2H3.
What are the key properties of 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one?
2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one has a molecular weight of 268.36 g/mol, XLogP of 0.74, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[3-(morpholine-4-carbonyl)piperidin-1-yl]propan-1-one is sourced from PubChem (CID 42935955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).