2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one

C16H19N3O2 — CID 174713625

IUPAC2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one
SMILESCc1cc(=O)n(-c2cccc(C3CNCCO3)c2)c(C)n1
InChIInChI=1S/C16H19N3O2/c1-11-8-16(20)19(12(2)18-11)14-5-3-4-13(9-14)15-10-17-6-7-21-15/h3-5,8-9,15,17H,6-7,10H2,1-2H3
InChIKeyFVDSDXQZGKAKDJ-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.51
Rot. Bonds2

About 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one

2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one (PubChem CID 174713625) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one.

Molecular Properties

Compound Name2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one
PubChem CID174713625
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one
SMILESCc1cc(=O)n(-c2cccc(C3CNCCO3)c2)c(C)n1
InChIInChI=1S/C16H19N3O2/c1-11-8-16(20)19(12(2)18-11)14-5-3-4-13(9-14)15-10-17-6-7-21-15/h3-5,8-9,15,17H,6-7,10H2,1-2H3
InChIKeyFVDSDXQZGKAKDJ-UHFFFAOYSA-N
XLogP1.51
TPSA56.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(3-methylphenyl)morpholine
CID 42182782
2-(3-methylphenyl)morpholine;hydrochloride
CID 71398912
2,6-dimethyl-3-(3-morpholin-4-ylphenyl)pyrimidin-4-one
CID 72948579
2-(3-bromo-4-methylphenyl)morpholine
CID 83730909
(2S)-2-(3-bromophenyl)morpholine
CID 28806253
3-[(2R)-morpholin-2-yl]benzoic acid
CID 169449190
2-(3,4-dimethylphenyl)morpholine
CID 43169342
1-methyl-1-(3-morpholin-2-ylphenyl)urea
CID 117342534
2-[3-(1,1-difluoroethyl)phenyl]morpholine
CID 117326793
2-[3-(4,4-dimethylcyclohexyl)phenyl]morpholine
CID 117436588
azane;2-phenylmorpholine
CID 174664757
2-[5-(3-bromo-4-methylphenyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971809

Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one?
The IUPAC name of 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one (CID 174713625) is 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one.
What is the SMILES notation for 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one?
The canonical SMILES for 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one is Cc1cc(=O)n(-c2cccc(C3CNCCO3)c2)c(C)n1.
What is the InChIKey of 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one?
The InChIKey is FVDSDXQZGKAKDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11-8-16(20)19(12(2)18-11)14-5-3-4-13(9-14)15-10-17-6-7-21-15/h3-5,8-9,15,17H,6-7,10H2,1-2H3.
What are the key properties of 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one?
2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one has a molecular weight of 285.35 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-3-(3-morpholin-2-ylphenyl)pyrimidin-4-one is sourced from PubChem (CID 174713625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).