4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide

C9H16N2O4 — CID 3809731

IUPAC4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide
SMILESCNC(=O)C1OC(C)(C)OC1C(=O)NC
InChIInChI=1S/C9H16N2O4/c1-9(2)14-5(7(12)10-3)6(15-9)8(13)11-4/h5-6H,1-4H3,(H,10,12)(H,11,13)
InChIKeyRJCZQLOBXZGLGZ-UHFFFAOYSA-N
MW216.24 g/mol
LogP-1.00
Rot. Bonds2

About 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide

4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide (PubChem CID 3809731) has the molecular formula C9H16N2O4 and a molecular weight of 216.24 g/mol. Its IUPAC name is 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide.

Molecular Properties

Compound Name4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide
PubChem CID3809731
Molecular FormulaC9H16N2O4
Molecular Weight216.24 g/mol
Exact Mass216.11
IUPAC Name4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide
SMILESCNC(=O)C1OC(C)(C)OC1C(=O)NC
InChIInChI=1S/C9H16N2O4/c1-9(2)14-5(7(12)10-3)6(15-9)8(13)11-4/h5-6H,1-4H3,(H,10,12)(H,11,13)
InChIKeyRJCZQLOBXZGLGZ-UHFFFAOYSA-N
XLogP-1.00
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.24
LogP ≤ 5-1.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide?
The IUPAC name of 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide (CID 3809731) is 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide.
What is the SMILES notation for 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide?
The canonical SMILES for 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide is CNC(=O)C1OC(C)(C)OC1C(=O)NC.
What is the InChIKey of 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide?
The InChIKey is RJCZQLOBXZGLGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N2O4/c1-9(2)14-5(7(12)10-3)6(15-9)8(13)11-4/h5-6H,1-4H3,(H,10,12)(H,11,13).
What are the key properties of 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide?
4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide has a molecular weight of 216.24 g/mol, XLogP of -1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,5-N,2,2-tetramethyl-1,3-dioxolane-4,5-dicarboxamide is sourced from PubChem (CID 3809731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).