oxolane-2,5-dicarboxamide

C6H10N2O3 — CID 13439968

IUPACoxolane-2,5-dicarboxamide
SMILESNC(=O)C1CCC(C(N)=O)O1
InChIInChI=1S/C6H10N2O3/c7-5(9)3-1-2-4(11-3)6(8)10/h3-4H,1-2H2,(H2,7,9)(H2,8,10)
InChIKeyWOSXHYGHGOYTBQ-UHFFFAOYSA-N
MW158.16 g/mol
LogP-1.50
Rot. Bonds2

About oxolane-2,5-dicarboxamide

oxolane-2,5-dicarboxamide (PubChem CID 13439968) has the molecular formula C6H10N2O3 and a molecular weight of 158.16 g/mol. Its IUPAC name is oxolane-2,5-dicarboxamide.

Molecular Properties

Compound Nameoxolane-2,5-dicarboxamide
PubChem CID13439968
Molecular FormulaC6H10N2O3
Molecular Weight158.16 g/mol
Exact Mass158.07
IUPAC Nameoxolane-2,5-dicarboxamide
SMILESNC(=O)C1CCC(C(N)=O)O1
InChIInChI=1S/C6H10N2O3/c7-5(9)3-1-2-4(11-3)6(8)10/h3-4H,1-2H2,(H2,7,9)(H2,8,10)
InChIKeyWOSXHYGHGOYTBQ-UHFFFAOYSA-N
XLogP-1.50
TPSA95.41 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.16
LogP ≤ 5-1.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of oxolane-2,5-dicarboxamide?
The IUPAC name of oxolane-2,5-dicarboxamide (CID 13439968) is oxolane-2,5-dicarboxamide.
What is the SMILES notation for oxolane-2,5-dicarboxamide?
The canonical SMILES for oxolane-2,5-dicarboxamide is NC(=O)C1CCC(C(N)=O)O1.
What is the InChIKey of oxolane-2,5-dicarboxamide?
The InChIKey is WOSXHYGHGOYTBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2O3/c7-5(9)3-1-2-4(11-3)6(8)10/h3-4H,1-2H2,(H2,7,9)(H2,8,10).
What are the key properties of oxolane-2,5-dicarboxamide?
oxolane-2,5-dicarboxamide has a molecular weight of 158.16 g/mol, XLogP of -1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for oxolane-2,5-dicarboxamide is sourced from PubChem (CID 13439968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).