N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide

C11H14F3NO — CID 11042638

IUPACN-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)C(F)(F)F)C1C=CCCC1
InChIInChI=1S/C11H14F3NO/c1-2-8-15(10(16)11(12,13)14)9-6-4-3-5-7-9/h2,4,6,9H,1,3,5,7-8H2
InChIKeyKITMVXNFBYTAII-UHFFFAOYSA-N
MW233.23 g/mol
LogP2.67
Rot. Bonds3

About N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide

N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide (PubChem CID 11042638) has the molecular formula C11H14F3NO and a molecular weight of 233.23 g/mol. Its IUPAC name is N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide.

Molecular Properties

Compound NameN-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide
PubChem CID11042638
Molecular FormulaC11H14F3NO
Molecular Weight233.23 g/mol
Exact Mass233.10
IUPAC NameN-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide
SMILESC=CCN(C(=O)C(F)(F)F)C1C=CCCC1
InChIInChI=1S/C11H14F3NO/c1-2-8-15(10(16)11(12,13)14)9-6-4-3-5-7-9/h2,4,6,9H,1,3,5,7-8H2
InChIKeyKITMVXNFBYTAII-UHFFFAOYSA-N
XLogP2.67
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide 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 N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide?
The IUPAC name of N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide (CID 11042638) is N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide.
What is the SMILES notation for N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide?
The canonical SMILES for N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide is C=CCN(C(=O)C(F)(F)F)C1C=CCCC1.
What is the InChIKey of N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide?
The InChIKey is KITMVXNFBYTAII-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F3NO/c1-2-8-15(10(16)11(12,13)14)9-6-4-3-5-7-9/h2,4,6,9H,1,3,5,7-8H2.
What are the key properties of N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide?
N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide has a molecular weight of 233.23 g/mol, XLogP of 2.67, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohex-2-en-1-yl-2,2,2-trifluoro-N-prop-2-enylacetamide is sourced from PubChem (CID 11042638), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).