1-(ethylamino)pyrrole-2,5-dione

C6H8N2O2 — CID 18671275

IUPAC1-(ethylamino)pyrrole-2,5-dione
SMILESCCNN1C(=O)C=CC1=O
InChIInChI=1S/C6H8N2O2/c1-2-7-8-5(9)3-4-6(8)10/h3-4,7H,2H2,1H3
InChIKeyUVKFDCOOPNCVMD-UHFFFAOYSA-N
MW140.14 g/mol
LogP-0.56
Rot. Bonds2

About 1-(ethylamino)pyrrole-2,5-dione

1-(ethylamino)pyrrole-2,5-dione (PubChem CID 18671275) has the molecular formula C6H8N2O2 and a molecular weight of 140.14 g/mol. Its IUPAC name is 1-(ethylamino)pyrrole-2,5-dione.

Molecular Properties

Compound Name1-(ethylamino)pyrrole-2,5-dione
PubChem CID18671275
Molecular FormulaC6H8N2O2
Molecular Weight140.14 g/mol
Exact Mass140.06
IUPAC Name1-(ethylamino)pyrrole-2,5-dione
SMILESCCNN1C(=O)C=CC1=O
InChIInChI=1S/C6H8N2O2/c1-2-7-8-5(9)3-4-6(8)10/h3-4,7H,2H2,1H3
InChIKeyUVKFDCOOPNCVMD-UHFFFAOYSA-N
XLogP-0.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.14
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

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Related Compounds

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CID 18671274
CID 18671274
CID 23354887
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CID 23502083
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CID 57514872
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Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)pyrrole-2,5-dione?
The IUPAC name of 1-(ethylamino)pyrrole-2,5-dione (CID 18671275) is 1-(ethylamino)pyrrole-2,5-dione.
What is the SMILES notation for 1-(ethylamino)pyrrole-2,5-dione?
The canonical SMILES for 1-(ethylamino)pyrrole-2,5-dione is CCNN1C(=O)C=CC1=O.
What is the InChIKey of 1-(ethylamino)pyrrole-2,5-dione?
The InChIKey is UVKFDCOOPNCVMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2O2/c1-2-7-8-5(9)3-4-6(8)10/h3-4,7H,2H2,1H3.
What are the key properties of 1-(ethylamino)pyrrole-2,5-dione?
1-(ethylamino)pyrrole-2,5-dione has a molecular weight of 140.14 g/mol, XLogP of -0.56, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)pyrrole-2,5-dione is sourced from PubChem (CID 18671275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).