2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine

C12H19N3O2 — CID 114469027

IUPAC2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine
SMILESCC(C)c1cc(OCC2CNCCO2)ncn1
InChIInChI=1S/C12H19N3O2/c1-9(2)11-5-12(15-8-14-11)17-7-10-6-13-3-4-16-10/h5,8-10,13H,3-4,6-7H2,1-2H3
InChIKeyYZDIEPBEDKMLIV-UHFFFAOYSA-N
MW237.30 g/mol
LogP0.97
Rot. Bonds4

About 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine

2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine (PubChem CID 114469027) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine.

Molecular Properties

Compound Name2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine
PubChem CID114469027
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine
SMILESCC(C)c1cc(OCC2CNCCO2)ncn1
InChIInChI=1S/C12H19N3O2/c1-9(2)11-5-12(15-8-14-11)17-7-10-6-13-3-4-16-10/h5,8-10,13H,3-4,6-7H2,1-2H3
InChIKeyYZDIEPBEDKMLIV-UHFFFAOYSA-N
XLogP0.97
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(morpholin-2-ylmethoxy)pyridine-4-carbonitrile
CID 114469059
2-[(4,6-dimethylpyrimidin-2-yl)oxymethyl]morpholine
CID 114469199
2-[[3-(morpholin-2-ylmethoxy)pyrazin-2-yl]oxymethyl]morpholine
CID 68542805
(2S)-2-[[3-methyl-5-[[(2S)-morpholin-2-yl]methoxy]phenoxy]methyl]morpholine
CID 170342980
2-[(3-propan-2-yloxy-2-pyridinyl)oxymethyl]morpholine
CID 114469138
2-[[5-(methoxymethyl)-1,2-oxazol-3-yl]methoxymethyl]morpholine
CID 114468442
(2S)-2-(methoxymethyl)morpholine;(2R)-2-(methoxymethyl)morpholine
CID 163652511
(2S)-2-(methoxymethyl)morpholine
CID 10103206
2-[(2-pyridin-2-yloxyphenoxy)methyl]morpholine
CID 12919862
2-[(3,6-dichloropyridazin-4-yl)oxymethyl]morpholine
CID 114468893
(2S)-2-[[4-[[(2S)-morpholin-2-yl]methoxymethyl]phenyl]methoxymethyl]morpholine
CID 170603335
2-[(4-chlorophenoxy)methyl]morpholine
CID 19964403

Frequently Asked Questions

What is the IUPAC name of 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine?
The IUPAC name of 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine (CID 114469027) is 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine.
What is the SMILES notation for 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine?
The canonical SMILES for 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine is CC(C)c1cc(OCC2CNCCO2)ncn1.
What is the InChIKey of 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine?
The InChIKey is YZDIEPBEDKMLIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-9(2)11-5-12(15-8-14-11)17-7-10-6-13-3-4-16-10/h5,8-10,13H,3-4,6-7H2,1-2H3.
What are the key properties of 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine?
2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine has a molecular weight of 237.30 g/mol, XLogP of 0.97, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-propan-2-ylpyrimidin-4-yl)oxymethyl]morpholine is sourced from PubChem (CID 114469027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).