(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide

C14H18N2O7 — CID 142119908

IUPAC(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide
SMILESCN(C)C(=O)N1C[C@]2(OCC3=COC(C)(C)O[C@H]3C2=O)OC1=O
InChIInChI=1S/C14H18N2O7/c1-13(2)20-5-8-6-21-14(10(17)9(8)22-13)7-16(12(19)23-14)11(18)15(3)4/h5,9H,6-7H2,1-4H3/t9-,14+/m1/s1
InChIKeyPREDQSPAMUFCRA-OTYXRUKQSA-N
MW326.31 g/mol
LogP0.45
Rot. Bonds

About (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide

(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide (PubChem CID 142119908) has the molecular formula C14H18N2O7 and a molecular weight of 326.31 g/mol. Its IUPAC name is (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide.

Molecular Properties

Compound Name(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide
PubChem CID142119908
Molecular FormulaC14H18N2O7
Molecular Weight326.31 g/mol
Exact Mass326.11
IUPAC Name(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide
SMILESCN(C)C(=O)N1C[C@]2(OCC3=COC(C)(C)O[C@H]3C2=O)OC1=O
InChIInChI=1S/C14H18N2O7/c1-13(2)20-5-8-6-21-14(10(17)9(8)22-13)7-16(12(19)23-14)11(18)15(3)4/h5,9H,6-7H2,1-4H3/t9-,14+/m1/s1
InChIKeyPREDQSPAMUFCRA-OTYXRUKQSA-N
XLogP0.45
TPSA94.61 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.31
LogP ≤ 50.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide?
The IUPAC name of (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide (CID 142119908) is (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide.
What is the SMILES notation for (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide?
The canonical SMILES for (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide is CN(C)C(=O)N1C[C@]2(OCC3=COC(C)(C)O[C@H]3C2=O)OC1=O.
What is the InChIKey of (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide?
The InChIKey is PREDQSPAMUFCRA-OTYXRUKQSA-N. The full InChI is InChI=1S/C14H18N2O7/c1-13(2)20-5-8-6-21-14(10(17)9(8)22-13)7-16(12(19)23-14)11(18)15(3)4/h5,9H,6-7H2,1-4H3/t9-,14+/m1/s1.
What are the key properties of (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide?
(5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide has a molecular weight of 326.31 g/mol, XLogP of 0.45, 0 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (5S,8'aR)-N,N,2',2'-tetramethyl-2,8'-dioxospiro[1,3-oxazolidine-5,7'-5,8a-dihydropyrano[4,3-d][1,3]dioxine]-3-carboxamide is sourced from PubChem (CID 142119908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).