4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one

C14H23N3O3 — CID 114775696

IUPAC4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one
SMILESCC(C)c1nc(OCC2CNCC(C)(C)O2)cc(=O)[nH]1
InChIInChI=1S/C14H23N3O3/c1-9(2)13-16-11(18)5-12(17-13)19-7-10-6-15-8-14(3,4)20-10/h5,9-10,15H,6-8H2,1-4H3,(H,16,17,18)
InChIKeyPJCMWJUAAVDJKD-UHFFFAOYSA-N
MW281.36 g/mol
LogP1.04
Rot. Bonds4

About 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one

4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one (PubChem CID 114775696) has the molecular formula C14H23N3O3 and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one
PubChem CID114775696
Molecular FormulaC14H23N3O3
Molecular Weight281.36 g/mol
Exact Mass281.17
IUPAC Name4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one
SMILESCC(C)c1nc(OCC2CNCC(C)(C)O2)cc(=O)[nH]1
InChIInChI=1S/C14H23N3O3/c1-9(2)13-16-11(18)5-12(17-13)19-7-10-6-15-8-14(3,4)20-10/h5,9-10,15H,6-8H2,1-4H3,(H,16,17,18)
InChIKeyPJCMWJUAAVDJKD-UHFFFAOYSA-N
XLogP1.04
TPSA76.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one with MolForge

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Related Compounds

6-[(6-methoxy-2-methylpyrimidin-4-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775678
2,2-dimethyl-6-[(4-methyl-6-propan-2-yloxypyrimidin-2-yl)oxymethyl]morpholine
CID 114775692
6-[(5-bromo-4-methyl-2-pyridinyl)oxymethyl]-2,2-dimethylmorpholine
CID 114869831
7-[(6,6-dimethylmorpholin-2-yl)methoxy]-2H-[1,2,4]triazolo[4,3-c]pyrimidin-3-one
CID 114775928
2,2-dimethyl-6-[(6-propoxypyrazin-2-yl)oxymethyl]morpholine
CID 114775746
6-[(4-methoxy-6-methylpyrimidin-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775691
4-[(1-aminocycloheptyl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one
CID 114586498
2-[(6,6-dimethylmorpholin-2-yl)methoxy]-4,6-dimethylpyridine-3-carboxamide
CID 114775730
6-[(4-chloro-1,3-thiazol-2-yl)oxymethyl]-2,2-dimethylmorpholine
CID 114775902
4-(2,2,3,3,3-pentafluoropropoxy)-2-propan-2-yl-1H-pyrimidin-6-one
CID 103241794
2,2-dimethyl-6-[(1-methylimidazol-2-yl)oxymethyl]morpholine
CID 114775834
4-(oxolan-3-yloxy)-2-propan-2-yl-1H-pyrimidin-6-one
CID 103241695

Frequently Asked Questions

What is the IUPAC name of 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one?
The IUPAC name of 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one (CID 114775696) is 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one?
The canonical SMILES for 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one is CC(C)c1nc(OCC2CNCC(C)(C)O2)cc(=O)[nH]1.
What is the InChIKey of 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one?
The InChIKey is PJCMWJUAAVDJKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O3/c1-9(2)13-16-11(18)5-12(17-13)19-7-10-6-15-8-14(3,4)20-10/h5,9-10,15H,6-8H2,1-4H3,(H,16,17,18).
What are the key properties of 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one?
4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one has a molecular weight of 281.36 g/mol, XLogP of 1.04, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6,6-dimethylmorpholin-2-yl)methoxy]-2-propan-2-yl-1H-pyrimidin-6-one is sourced from PubChem (CID 114775696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).