(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine

C18H23N5O2 — CID 138018909

IUPAC(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
SMILESCc1nnc([C@H]2CN(c3cc(C4CC4)nc(C4CC4)n3)C[C@@H](C)O2)o1
InChIInChI=1S/C18H23N5O2/c1-10-8-23(9-15(24-10)18-22-21-11(2)25-18)16-7-14(12-3-4-12)19-17(20-16)13-5-6-13/h7,10,12-13,15H,3-6,8-9H2,1-2H3/t10-,15-/m1/s1
InChIKeyRMGGOXOSJOAQDW-MEBBXXQBSA-N
MW341.42 g/mol
LogP2.89
Rot. Bonds4

About (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine

(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (PubChem CID 138018909) has the molecular formula C18H23N5O2 and a molecular weight of 341.42 g/mol. Its IUPAC name is (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.

Molecular Properties

Compound Name(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
PubChem CID138018909
Molecular FormulaC18H23N5O2
Molecular Weight341.42 g/mol
Exact Mass341.19
IUPAC Name(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
SMILESCc1nnc([C@H]2CN(c3cc(C4CC4)nc(C4CC4)n3)C[C@@H](C)O2)o1
InChIInChI=1S/C18H23N5O2/c1-10-8-23(9-15(24-10)18-22-21-11(2)25-18)16-7-14(12-3-4-12)19-17(20-16)13-5-6-13/h7,10,12-13,15H,3-6,8-9H2,1-2H3/t10-,15-/m1/s1
InChIKeyRMGGOXOSJOAQDW-MEBBXXQBSA-N
XLogP2.89
TPSA77.17 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.42
LogP ≤ 52.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The IUPAC name of (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (CID 138018909) is (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.
What is the SMILES notation for (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The canonical SMILES for (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is Cc1nnc([C@H]2CN(c3cc(C4CC4)nc(C4CC4)n3)C[C@@H](C)O2)o1.
What is the InChIKey of (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The InChIKey is RMGGOXOSJOAQDW-MEBBXXQBSA-N. The full InChI is InChI=1S/C18H23N5O2/c1-10-8-23(9-15(24-10)18-22-21-11(2)25-18)16-7-14(12-3-4-12)19-17(20-16)13-5-6-13/h7,10,12-13,15H,3-6,8-9H2,1-2H3/t10-,15-/m1/s1.
What are the key properties of (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
(2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine has a molecular weight of 341.42 g/mol, XLogP of 2.89, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,6R)-4-(2,6-dicyclopropylpyrimidin-4-yl)-2-methyl-6-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is sourced from PubChem (CID 138018909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).