1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one

C15H23N3O3 — CID 124960101

IUPAC1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one
SMILESCOC(C)(C)C(=O)N1CCO[C@H](c2nc(C)cc(C)n2)C1
InChIInChI=1S/C15H23N3O3/c1-10-8-11(2)17-13(16-10)12-9-18(6-7-21-12)14(19)15(3,4)20-5/h8,12H,6-7,9H2,1-5H3/t12-/m0/s1
InChIKeyGSHHHVZTDJXJEB-LBPRGKRZSA-N
MW293.37 g/mol
LogP1.42
Rot. Bonds3

About 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one

1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one (PubChem CID 124960101) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one.

Molecular Properties

Compound Name1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one
PubChem CID124960101
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC Name1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one
SMILESCOC(C)(C)C(=O)N1CCO[C@H](c2nc(C)cc(C)n2)C1
InChIInChI=1S/C15H23N3O3/c1-10-8-11(2)17-13(16-10)12-9-18(6-7-21-12)14(19)15(3,4)20-5/h8,12H,6-7,9H2,1-5H3/t12-/m0/s1
InChIKeyGSHHHVZTDJXJEB-LBPRGKRZSA-N
XLogP1.42
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrimidin-2-ylmethanone
CID 110115566
[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-(1,3-thiazol-5-yl)methanone
CID 124971089
[(2R)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-pyrazin-2-ylmethanone
CID 124972759
(1,3-dimethylpyrazol-4-yl)-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 124990802
(2,4-dimethylpyrimidin-5-yl)-[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]methanone
CID 110115620
[2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-quinolin-6-ylmethanone
CID 110115591
(5-tert-butyl-1H-pyrazol-3-yl)-[(2S)-2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]methanone
CID 124969938
(2S)-4-cyclopentylsulfonyl-2-(4,6-dimethylpyrimidin-2-yl)morpholine
CID 125011329
1-[(2R)-2-[4-[(4,6-dimethylpyrimidin-2-yl)amino]-6-methyl-2-pyridinyl]morpholin-4-yl]-2-methoxyethanone
CID 124990655
tert-butyl 2-(5-bromo-3-methyl-2-pyridinyl)morpholine-4-carboxylate
CID 118485004
(2S)-2-amino-3,3-dimethyl-1-[2-(5-methyl-1H-1,2,4-triazol-3-yl)morpholin-4-yl]butan-1-one;dihydrochloride
CID 119897734
2-(4-methoxyphenyl)-2-methyl-1-[(2R)-2-(5-propan-2-yl-1,2,4-oxadiazol-3-yl)morpholin-4-yl]propan-1-one
CID 97345083

Frequently Asked Questions

What is the IUPAC name of 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one?
The IUPAC name of 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one (CID 124960101) is 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one.
What is the SMILES notation for 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one?
The canonical SMILES for 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one is COC(C)(C)C(=O)N1CCO[C@H](c2nc(C)cc(C)n2)C1.
What is the InChIKey of 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one?
The InChIKey is GSHHHVZTDJXJEB-LBPRGKRZSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-10-8-11(2)17-13(16-10)12-9-18(6-7-21-12)14(19)15(3,4)20-5/h8,12H,6-7,9H2,1-5H3/t12-/m0/s1.
What are the key properties of 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one?
1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one has a molecular weight of 293.37 g/mol, XLogP of 1.42, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2S)-2-(4,6-dimethylpyrimidin-2-yl)morpholin-4-yl]-2-methoxy-2-methylpropan-1-one is sourced from PubChem (CID 124960101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).