N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide

C14H26N2O2 — CID 66255928

IUPACN-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide
SMILESC=C(C)CN(CC)C(=O)C1COCC1NCCC
InChIInChI=1S/C14H26N2O2/c1-5-7-15-13-10-18-9-12(13)14(17)16(6-2)8-11(3)4/h12-13,15H,3,5-10H2,1-2,4H3
InChIKeyJXXKJVOHYJFYIN-UHFFFAOYSA-N
MW254.37 g/mol
LogP1.43
Rot. Bonds7

About N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide

N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide (PubChem CID 66255928) has the molecular formula C14H26N2O2 and a molecular weight of 254.37 g/mol. Its IUPAC name is N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide
PubChem CID66255928
Molecular FormulaC14H26N2O2
Molecular Weight254.37 g/mol
Exact Mass254.20
IUPAC NameN-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide
SMILESC=C(C)CN(CC)C(=O)C1COCC1NCCC
InChIInChI=1S/C14H26N2O2/c1-5-7-15-13-10-18-9-12(13)14(17)16(6-2)8-11(3)4/h12-13,15H,3,5-10H2,1-2,4H3
InChIKeyJXXKJVOHYJFYIN-UHFFFAOYSA-N
XLogP1.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide?
The IUPAC name of N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide (CID 66255928) is N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide?
The canonical SMILES for N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide is C=C(C)CN(CC)C(=O)C1COCC1NCCC.
What is the InChIKey of N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide?
The InChIKey is JXXKJVOHYJFYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O2/c1-5-7-15-13-10-18-9-12(13)14(17)16(6-2)8-11(3)4/h12-13,15H,3,5-10H2,1-2,4H3.
What are the key properties of N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide?
N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide has a molecular weight of 254.37 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-methylprop-2-enyl)-4-(propylamino)oxolane-3-carboxamide is sourced from PubChem (CID 66255928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).