4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine

C15H19N3OS — CID 133379218

IUPAC4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine
SMILESCc1cc(N2CC(C)OC(c3ccsc3)C2)nc(C)n1
InChIInChI=1S/C15H19N3OS/c1-10-6-15(17-12(3)16-10)18-7-11(2)19-14(8-18)13-4-5-20-9-13/h4-6,9,11,14H,7-8H2,1-3H3
InChIKeyGHMRDMGIVSGVJG-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.12
Rot. Bonds2

About 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine

4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine (PubChem CID 133379218) has the molecular formula C15H19N3OS and a molecular weight of 289.40 g/mol. Its IUPAC name is 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine.

Molecular Properties

Compound Name4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine
PubChem CID133379218
Molecular FormulaC15H19N3OS
Molecular Weight289.40 g/mol
Exact Mass289.12
IUPAC Name4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine
SMILESCc1cc(N2CC(C)OC(c3ccsc3)C2)nc(C)n1
InChIInChI=1S/C15H19N3OS/c1-10-6-15(17-12(3)16-10)18-7-11(2)19-14(8-18)13-4-5-20-9-13/h4-6,9,11,14H,7-8H2,1-3H3
InChIKeyGHMRDMGIVSGVJG-UHFFFAOYSA-N
XLogP3.12
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(2S,6R)-2-methyl-4-(6-methyl-2-pyridin-4-ylpyrimidin-4-yl)-6-thiophen-3-ylmorpholine
CID 99716093
2-methyl-4-(6-methylpyrimidin-4-yl)-6-thiophen-3-ylmorpholine
CID 133379222
(2S,6R)-4-(5-fluoro-2-pyridinyl)-2-methyl-6-thiophen-3-ylmorpholine
CID 124851478
2-methyl-4-(6-methylsulfanylpyridazin-3-yl)-6-thiophen-3-ylmorpholine
CID 133379191
4-(6-ethoxypyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine
CID 133490501
6-[(2S,6S)-2-methyl-6-thiophen-3-ylmorpholin-4-yl]pyrimidine-4-carbonitrile
CID 99778550
(2S,6S)-2-methyl-4-(4-methyl-5-nitro-2-pyridinyl)-6-thiophen-3-ylmorpholine
CID 99107655
(2S,6S)-4-(6-chloro-2-methylpyrimidin-4-yl)-2,6-dimethylmorpholine
CID 129367907
4-(6-ethyl-2-methylpyrimidin-4-yl)-2-thiophen-3-ylmorpholine
CID 133472437
4-(6-fluoroquinazolin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine
CID 133379376
2-methyl-4-(2-pyridin-4-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-6-thiophen-3-ylmorpholine
CID 133379383
1-(2-methyl-6-thiophen-3-ylmorpholin-4-yl)ethanone
CID 167980764

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine?
The IUPAC name of 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine (CID 133379218) is 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine.
What is the SMILES notation for 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine?
The canonical SMILES for 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine is Cc1cc(N2CC(C)OC(c3ccsc3)C2)nc(C)n1.
What is the InChIKey of 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine?
The InChIKey is GHMRDMGIVSGVJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3OS/c1-10-6-15(17-12(3)16-10)18-7-11(2)19-14(8-18)13-4-5-20-9-13/h4-6,9,11,14H,7-8H2,1-3H3.
What are the key properties of 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine?
4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine has a molecular weight of 289.40 g/mol, XLogP of 3.12, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylpyrimidin-4-yl)-2-methyl-6-thiophen-3-ylmorpholine is sourced from PubChem (CID 133379218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).