2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one

C15H28N2O2 — CID 129255640

IUPAC2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one
SMILESCC(C)(C)C(=O)N1CCOC(CN2CCCCC2)C1
InChIInChI=1S/C15H28N2O2/c1-15(2,3)14(18)17-9-10-19-13(12-17)11-16-7-5-4-6-8-16/h13H,4-12H2,1-3H3
InChIKeyNDZPEGPDOONQSX-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.75
Rot. Bonds2

About 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one

2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one (PubChem CID 129255640) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one.

Molecular Properties

Compound Name2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one
PubChem CID129255640
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one
SMILESCC(C)(C)C(=O)N1CCOC(CN2CCCCC2)C1
InChIInChI=1S/C15H28N2O2/c1-15(2,3)14(18)17-9-10-19-13(12-17)11-16-7-5-4-6-8-16/h13H,4-12H2,1-3H3
InChIKeyNDZPEGPDOONQSX-UHFFFAOYSA-N
XLogP1.75
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one?
The IUPAC name of 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one (CID 129255640) is 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one.
What is the SMILES notation for 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one?
The canonical SMILES for 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one is CC(C)(C)C(=O)N1CCOC(CN2CCCCC2)C1.
What is the InChIKey of 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one?
The InChIKey is NDZPEGPDOONQSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-15(2,3)14(18)17-9-10-19-13(12-17)11-16-7-5-4-6-8-16/h13H,4-12H2,1-3H3.
What are the key properties of 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one?
2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one has a molecular weight of 268.40 g/mol, XLogP of 1.75, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-1-[2-(piperidin-1-ylmethyl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 129255640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).