N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide

C10H15F3N2O — CID 78914688

IUPACN,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESC=CCN(CC=C)C(=O)CNCC(F)(F)F
InChIInChI=1S/C10H15F3N2O/c1-3-5-15(6-4-2)9(16)7-14-8-10(11,12)13/h3-4,14H,1-2,5-8H2
InChIKeyPPPHPMRECWKADC-UHFFFAOYSA-N
MW236.24 g/mol
LogP1.34
Rot. Bonds7

About N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide

N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 78914688) has the molecular formula C10H15F3N2O and a molecular weight of 236.24 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID78914688
Molecular FormulaC10H15F3N2O
Molecular Weight236.24 g/mol
Exact Mass236.11
IUPAC NameN,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide
SMILESC=CCN(CC=C)C(=O)CNCC(F)(F)F
InChIInChI=1S/C10H15F3N2O/c1-3-5-15(6-4-2)9(16)7-14-8-10(11,12)13/h3-4,14H,1-2,5-8H2
InChIKeyPPPHPMRECWKADC-UHFFFAOYSA-N
XLogP1.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.24
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide (CID 78914688) is N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide is C=CCN(CC=C)C(=O)CNCC(F)(F)F.
What is the InChIKey of N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is PPPHPMRECWKADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2O/c1-3-5-15(6-4-2)9(16)7-14-8-10(11,12)13/h3-4,14H,1-2,5-8H2.
What are the key properties of N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide?
N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 236.24 g/mol, XLogP of 1.34, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(prop-2-enyl)-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 78914688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).