(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine

C13H21N3O2 — CID 129350849

IUPAC(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
SMILESCOC[C@H]1CN(Cc2ncccn2)CC(C)(C)O1
InChIInChI=1S/C13H21N3O2/c1-13(2)10-16(7-11(18-13)9-17-3)8-12-14-5-4-6-15-12/h4-6,11H,7-10H2,1-3H3/t11-/m1/s1
InChIKeyKWUFFLBISHZNPQ-LLVKDONJSA-N
MW251.33 g/mol
LogP1.10
Rot. Bonds4

About (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine

(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine (PubChem CID 129350849) has the molecular formula C13H21N3O2 and a molecular weight of 251.33 g/mol. Its IUPAC name is (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine.

Molecular Properties

Compound Name(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
PubChem CID129350849
Molecular FormulaC13H21N3O2
Molecular Weight251.33 g/mol
Exact Mass251.16
IUPAC Name(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
SMILESCOC[C@H]1CN(Cc2ncccn2)CC(C)(C)O1
InChIInChI=1S/C13H21N3O2/c1-13(2)10-16(7-11(18-13)9-17-3)8-12-14-5-4-6-15-12/h4-6,11H,7-10H2,1-3H3/t11-/m1/s1
InChIKeyKWUFFLBISHZNPQ-LLVKDONJSA-N
XLogP1.10
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 51.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(6S)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine
CID 129350850
6-(methoxymethyl)-2,2-dimethyl-4-[(3-methylquinoxalin-2-yl)methyl]morpholine
CID 128978215
4-[[6-(methoxymethyl)-2,2-dimethylmorpholin-4-yl]methyl]pyridin-2-amine
CID 128975935
(6S)-4-[(2,6-dichlorophenyl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 167885794
(6S)-4-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129345524
(6S)-6-(methoxymethyl)-2,2-dimethyl-4-[(3-methyltriazol-4-yl)methyl]morpholine
CID 129491465
(6S)-4-(imidazo[1,2-a]pyrazin-3-ylmethyl)-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129482791
4-[(5-ethyl-1,3,4-oxadiazol-2-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 128978245
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-[[2-(2-methylpropyl)-1,2,4-triazol-3-yl]methyl]morpholine
CID 129345619
(6R)-4-[[5-(2-fluorophenyl)-1,3-oxazol-2-yl]methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 129483204
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]morpholine
CID 129345533
4-[(4-cyclopropyl-5-methyl-1,2,4-triazol-3-yl)methyl]-6-(methoxymethyl)-2,2-dimethylmorpholine
CID 128975934

Frequently Asked Questions

What is the IUPAC name of (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine?
The IUPAC name of (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine (CID 129350849) is (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine.
What is the SMILES notation for (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine?
The canonical SMILES for (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine is COC[C@H]1CN(Cc2ncccn2)CC(C)(C)O1.
What is the InChIKey of (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine?
The InChIKey is KWUFFLBISHZNPQ-LLVKDONJSA-N. The full InChI is InChI=1S/C13H21N3O2/c1-13(2)10-16(7-11(18-13)9-17-3)8-12-14-5-4-6-15-12/h4-6,11H,7-10H2,1-3H3/t11-/m1/s1.
What are the key properties of (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine?
(6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine has a molecular weight of 251.33 g/mol, XLogP of 1.10, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-6-(methoxymethyl)-2,2-dimethyl-4-(pyrimidin-2-ylmethyl)morpholine is sourced from PubChem (CID 129350849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).