[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone

C15H24N2O6 — CID 24881834

IUPAC[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone
SMILESCC1(C)O[C@@H](C(=O)N2CCOCC2)[C@H](C(=O)N2CCOCC2)O1
InChIInChI=1S/C15H24N2O6/c1-15(2)22-11(13(18)16-3-7-20-8-4-16)12(23-15)14(19)17-5-9-21-10-6-17/h11-12H,3-10H2,1-2H3/t11-,12-/m1/s1
InChIKeyROAHUKZWBJLJOV-VXGBXAGGSA-N
MW328.37 g/mol
LogP-0.78
Rot. Bonds2

About [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone

[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone (PubChem CID 24881834) has the molecular formula C15H24N2O6 and a molecular weight of 328.37 g/mol. Its IUPAC name is [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone
PubChem CID24881834
Molecular FormulaC15H24N2O6
Molecular Weight328.37 g/mol
Exact Mass328.16
IUPAC Name[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone
SMILESCC1(C)O[C@@H](C(=O)N2CCOCC2)[C@H](C(=O)N2CCOCC2)O1
InChIInChI=1S/C15H24N2O6/c1-15(2)22-11(13(18)16-3-7-20-8-4-16)12(23-15)14(19)17-5-9-21-10-6-17/h11-12H,3-10H2,1-2H3/t11-,12-/m1/s1
InChIKeyROAHUKZWBJLJOV-VXGBXAGGSA-N
XLogP-0.78
TPSA77.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.37
LogP ≤ 5-0.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone (CID 24881834) is [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone is CC1(C)O[C@@H](C(=O)N2CCOCC2)[C@H](C(=O)N2CCOCC2)O1.
What is the InChIKey of [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone?
The InChIKey is ROAHUKZWBJLJOV-VXGBXAGGSA-N. The full InChI is InChI=1S/C15H24N2O6/c1-15(2)22-11(13(18)16-3-7-20-8-4-16)12(23-15)14(19)17-5-9-21-10-6-17/h11-12H,3-10H2,1-2H3/t11-,12-/m1/s1.
What are the key properties of [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone?
[(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone has a molecular weight of 328.37 g/mol, XLogP of -0.78, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R,5R)-2,2-dimethyl-5-(morpholine-4-carbonyl)-1,3-dioxolan-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 24881834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).