2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide

C15H23N3O3 — CID 114775730

IUPAC2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(OCC2CNCC(C)(C)O2)n1
InChIInChI=1S/C15H23N3O3/c1-9-5-10(2)18-14(12(9)13(16)19)20-7-11-6-17-8-15(3,4)21-11/h5,11,17H,6-8H2,1-4H3,(H2,16,19)
InChIKeyXMNMRNGVVWBPDF-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.94
Rot. Bonds4

About 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide

2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide (PubChem CID 114775730) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide
PubChem CID114775730
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide
SMILESCc1cc(C)c(C(N)=O)c(OCC2CNCC(C)(C)O2)n1
InChIInChI=1S/C15H23N3O3/c1-9-5-10(2)18-14(12(9)13(16)19)20-7-11-6-17-8-15(3,4)21-11/h5,11,17H,6-8H2,1-4H3,(H2,16,19)
InChIKeyXMNMRNGVVWBPDF-UHFFFAOYSA-N
XLogP0.94
TPSA86.47 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide?
The IUPAC name of 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide (CID 114775730) is 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide.
What is the SMILES notation for 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide?
The canonical SMILES for 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide is Cc1cc(C)c(C(N)=O)c(OCC2CNCC(C)(C)O2)n1.
What is the InChIKey of 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide?
The InChIKey is XMNMRNGVVWBPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-9-5-10(2)18-14(12(9)13(16)19)20-7-11-6-17-8-15(3,4)21-11/h5,11,17H,6-8H2,1-4H3,(H2,16,19).
What are the key properties of 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide?
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide has a molecular weight of 293.37 g/mol, XLogP of 0.94, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide is sourced from PubChem (CID 114775730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).