4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide

C13H22N2O2 — CID 66260004

IUPAC4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide
SMILESC=CCN(CC=C)C(=O)C1COCC1NCC
InChIInChI=1S/C13H22N2O2/c1-4-7-15(8-5-2)13(16)11-9-17-10-12(11)14-6-3/h4-5,11-12,14H,1-2,6-10H2,3H3
InChIKeyPGINYHFMGBRZAG-UHFFFAOYSA-N
MW238.33 g/mol
LogP0.81
Rot. Bonds7

About 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide

4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide (PubChem CID 66260004) has the molecular formula C13H22N2O2 and a molecular weight of 238.33 g/mol. Its IUPAC name is 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide
PubChem CID66260004
Molecular FormulaC13H22N2O2
Molecular Weight238.33 g/mol
Exact Mass238.17
IUPAC Name4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide
SMILESC=CCN(CC=C)C(=O)C1COCC1NCC
InChIInChI=1S/C13H22N2O2/c1-4-7-15(8-5-2)13(16)11-9-17-10-12(11)14-6-3/h4-5,11-12,14H,1-2,6-10H2,3H3
InChIKeyPGINYHFMGBRZAG-UHFFFAOYSA-N
XLogP0.81
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 50.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide?
The IUPAC name of 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide (CID 66260004) is 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide.
What is the SMILES notation for 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide?
The canonical SMILES for 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide is C=CCN(CC=C)C(=O)C1COCC1NCC.
What is the InChIKey of 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide?
The InChIKey is PGINYHFMGBRZAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2/c1-4-7-15(8-5-2)13(16)11-9-17-10-12(11)14-6-3/h4-5,11-12,14H,1-2,6-10H2,3H3.
What are the key properties of 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide?
4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide has a molecular weight of 238.33 g/mol, XLogP of 0.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(ethylamino)-N,N-bis(prop-2-enyl)oxolane-3-carboxamide is sourced from PubChem (CID 66260004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).