N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide

C11H15F3N2O2 — CID 110280320

IUPACN,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide
SMILESC=CCN(CC=C)C(=O)C(C)NC(=O)C(F)(F)F
InChIInChI=1S/C11H15F3N2O2/c1-4-6-16(7-5-2)9(17)8(3)15-10(18)11(12,13)14/h4-5,8H,1-2,6-7H2,3H3,(H,15,18)
InChIKeyGZPWEECSRQMAGM-UHFFFAOYSA-N
MW264.25 g/mol
LogP1.25
Rot. Bonds6

About N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide

N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide (PubChem CID 110280320) has the molecular formula C11H15F3N2O2 and a molecular weight of 264.25 g/mol. Its IUPAC name is N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide.

Molecular Properties

Compound NameN,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide
PubChem CID110280320
Molecular FormulaC11H15F3N2O2
Molecular Weight264.25 g/mol
Exact Mass264.11
IUPAC NameN,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide
SMILESC=CCN(CC=C)C(=O)C(C)NC(=O)C(F)(F)F
InChIInChI=1S/C11H15F3N2O2/c1-4-6-16(7-5-2)9(17)8(3)15-10(18)11(12,13)14/h4-5,8H,1-2,6-7H2,3H3,(H,15,18)
InChIKeyGZPWEECSRQMAGM-UHFFFAOYSA-N
XLogP1.25
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.25
LogP ≤ 51.25
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-trifluoroacetyl)amino]propanamide?
The IUPAC name of N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide (CID 110280320) is N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide.
What is the SMILES notation for N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide?
The canonical SMILES for N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide is C=CCN(CC=C)C(=O)C(C)NC(=O)C(F)(F)F.
What is the InChIKey of N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide?
The InChIKey is GZPWEECSRQMAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15F3N2O2/c1-4-6-16(7-5-2)9(17)8(3)15-10(18)11(12,13)14/h4-5,8H,1-2,6-7H2,3H3,(H,15,18).
What are the key properties of N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide?
N,N-bis(prop-2-enyl)-2-[(2,2,2-trifluoroacetyl)amino]propanamide has a molecular weight of 264.25 g/mol, XLogP of 1.25, 6 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-trifluoroacetyl)amino]propanamide is sourced from PubChem (CID 110280320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).