2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide

C10H18N2O3 — CID 67189417

IUPAC2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide
SMILESCC1(C)OC2C(C)(CNC2(C)C(N)=O)O1
InChIInChI=1S/C10H18N2O3/c1-8(2)14-6-9(3,15-8)5-12-10(6,4)7(11)13/h6,12H,5H2,1-4H3,(H2,11,13)
InChIKeyHWQXUDIJHLXJJI-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.26
Rot. Bonds1

About 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide

2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide (PubChem CID 67189417) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide.

Molecular Properties

Compound Name2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide
PubChem CID67189417
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide
SMILESCC1(C)OC2C(C)(CNC2(C)C(N)=O)O1
InChIInChI=1S/C10H18N2O3/c1-8(2)14-6-9(3,15-8)5-12-10(6,4)7(11)13/h6,12H,5H2,1-4H3,(H2,11,13)
InChIKeyHWQXUDIJHLXJJI-UHFFFAOYSA-N
XLogP-0.26
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide?
The IUPAC name of 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide (CID 67189417) is 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide.
What is the SMILES notation for 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide?
The canonical SMILES for 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide is CC1(C)OC2C(C)(CNC2(C)C(N)=O)O1.
What is the InChIKey of 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide?
The InChIKey is HWQXUDIJHLXJJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-8(2)14-6-9(3,15-8)5-12-10(6,4)7(11)13/h6,12H,5H2,1-4H3,(H2,11,13).
What are the key properties of 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide?
2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide has a molecular weight of 214.26 g/mol, XLogP of -0.26, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3a,6-tetramethyl-5,6a-dihydro-4H-[1,3]dioxolo[4,5-c]pyrrole-6-carboxamide is sourced from PubChem (CID 67189417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).