2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide

C13H22N2O3 — CID 108913093

IUPAC2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide
SMILESCC1CN(C(=O)NC=C2CCOCC2)CC(C)O1
InChIInChI=1S/C13H22N2O3/c1-10-8-15(9-11(2)18-10)13(16)14-7-12-3-5-17-6-4-12/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,16)
InChIKeySSYORJNZSWAUJD-UHFFFAOYSA-N
MW254.33 g/mol
LogP1.50
Rot. Bonds1

About 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide

2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide (PubChem CID 108913093) has the molecular formula C13H22N2O3 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide.

Molecular Properties

Compound Name2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide
PubChem CID108913093
Molecular FormulaC13H22N2O3
Molecular Weight254.33 g/mol
Exact Mass254.16
IUPAC Name2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide
SMILESCC1CN(C(=O)NC=C2CCOCC2)CC(C)O1
InChIInChI=1S/C13H22N2O3/c1-10-8-15(9-11(2)18-10)13(16)14-7-12-3-5-17-6-4-12/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,16)
InChIKeySSYORJNZSWAUJD-UHFFFAOYSA-N
XLogP1.50
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-dimethyl-N-(2-methylprop-1-enyl)morpholine-4-carboxamide
CID 108909796
N-(cyclohexylidenemethyl)-2,6-dimethylmorpholine-4-carboxamide
CID 108912402
N-(oxan-4-ylidenemethyl)piperazine-1-carboxamide
CID 108913064
4-methyl-N-(oxan-4-ylidenemethyl)piperidine-1-carboxamide
CID 108913096
1-(2-Methoxyethyl)-3-(oxan-4-ylidenemethyl)urea
CID 108913100
1-Methyl-1-(1-methylpiperidin-4-yl)-3-(oxan-4-ylidenemethyl)urea
CID 108913114
4-acetyl-N-(oxan-4-ylidenemethyl)piperazine-1-carboxamide
CID 108913121
N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide
CID 108913128
4-methyl-N-(oxan-4-ylidenemethyl)piperazine-1-carboxamide
CID 108913177
N-(oxan-4-ylidenemethyl)piperidine-1-carboxamide
CID 108913178
1-(2-Morpholin-4-ylethyl)-3-(oxan-4-ylidenemethyl)urea
CID 108913180
1-(3-Morpholin-4-ylpropyl)-3-(oxan-4-ylidenemethyl)urea
CID 108913187

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide?
The IUPAC name of 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide (CID 108913093) is 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide.
What is the SMILES notation for 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide?
The canonical SMILES for 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide is CC1CN(C(=O)NC=C2CCOCC2)CC(C)O1.
What is the InChIKey of 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide?
The InChIKey is SSYORJNZSWAUJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O3/c1-10-8-15(9-11(2)18-10)13(16)14-7-12-3-5-17-6-4-12/h7,10-11H,3-6,8-9H2,1-2H3,(H,14,16).
What are the key properties of 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide?
2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-N-(oxan-4-ylidenemethyl)morpholine-4-carboxamide is sourced from PubChem (CID 108913093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).