(2Z)-2-fluorohexa-2,5-dienamide

C6H8FNO — CID 87881751

IUPAC(2Z)-2-fluorohexa-2,5-dienamide
SMILESC=CC/C=C(\F)C(N)=O
InChIInChI=1S/C6H8FNO/c1-2-3-4-5(7)6(8)9/h2,4H,1,3H2,(H2,8,9)/b5-4-
InChIKeyMOPBBWUCMRXZRD-PLNGDYQASA-N
MW129.13 g/mol
LogP0.90
Rot. Bonds3

About (2Z)-2-fluorohexa-2,5-dienamide

(2Z)-2-fluorohexa-2,5-dienamide (PubChem CID 87881751) has the molecular formula C6H8FNO and a molecular weight of 129.13 g/mol. Its IUPAC name is (2Z)-2-fluorohexa-2,5-dienamide.

Molecular Properties

Compound Name(2Z)-2-fluorohexa-2,5-dienamide
PubChem CID87881751
Molecular FormulaC6H8FNO
Molecular Weight129.13 g/mol
Exact Mass129.06
IUPAC Name(2Z)-2-fluorohexa-2,5-dienamide
SMILESC=CC/C=C(\F)C(N)=O
InChIInChI=1S/C6H8FNO/c1-2-3-4-5(7)6(8)9/h2,4H,1,3H2,(H2,8,9)/b5-4-
InChIKeyMOPBBWUCMRXZRD-PLNGDYQASA-N
XLogP0.90
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.13
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Analyze (2Z)-2-fluorohexa-2,5-dienamide with MolForge

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

Launch Full Analysis

Related Compounds

cis-2-Pentenoic acid amide
CID 6432143
Hepta-2,4-dienamide
CID 11693907
2-Pentenamide, (2E)-
CID 5973527
(E)-hex-2-enamide
CID 6505436
cis-2-Hexenoic acid amide
CID 5463548
(2Z,4Z)-hepta-2,4-dienamide
CID 11480441
pentenamid-Konzentrationen
CID 139986
4-Methylpent-2-enamide
CID 274613
Methylene-bisacrylamide
CID 53800990
CID 53996891
CID 53996891
Hexene carboxylic acid amide
CID 54092131
4,4,5,6,6-Pentafluorohexa-2,5-dienamide
CID 88728990

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-fluorohexa-2,5-dienamide?
The IUPAC name of (2Z)-2-fluorohexa-2,5-dienamide (CID 87881751) is (2Z)-2-fluorohexa-2,5-dienamide.
What is the SMILES notation for (2Z)-2-fluorohexa-2,5-dienamide?
The canonical SMILES for (2Z)-2-fluorohexa-2,5-dienamide is C=CC/C=C(\F)C(N)=O.
What is the InChIKey of (2Z)-2-fluorohexa-2,5-dienamide?
The InChIKey is MOPBBWUCMRXZRD-PLNGDYQASA-N. The full InChI is InChI=1S/C6H8FNO/c1-2-3-4-5(7)6(8)9/h2,4H,1,3H2,(H2,8,9)/b5-4-.
What are the key properties of (2Z)-2-fluorohexa-2,5-dienamide?
(2Z)-2-fluorohexa-2,5-dienamide has a molecular weight of 129.13 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-2-fluorohexa-2,5-dienamide is sourced from PubChem (CID 87881751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).