(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine

C11H9F2N — CID 170142846

IUPAC(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine
SMILESC=C/N=C1\C=CC(F)=C\C1=C\C(=C)F
InChIInChI=1S/C11H9F2N/c1-3-14-11-5-4-10(13)7-9(11)6-8(2)12/h3-7H,1-2H2/b9-6-,14-11+
InChIKeyRNGNWKAGSIZRFG-BLMPOAMMSA-N
MW193.20 g/mol
LogP3.40
Rot. Bonds2

About (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine

(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine (PubChem CID 170142846) has the molecular formula C11H9F2N and a molecular weight of 193.20 g/mol. Its IUPAC name is (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine.

Molecular Properties

Compound Name(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine
PubChem CID170142846
Molecular FormulaC11H9F2N
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine
SMILESC=C/N=C1\C=CC(F)=C\C1=C\C(=C)F
InChIInChI=1S/C11H9F2N/c1-3-14-11-5-4-10(13)7-9(11)6-8(2)12/h3-7H,1-2H2/b9-6-,14-11+
InChIKeyRNGNWKAGSIZRFG-BLMPOAMMSA-N
XLogP3.40
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine?
The IUPAC name of (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine (CID 170142846) is (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine.
What is the SMILES notation for (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine?
The canonical SMILES for (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine is C=C/N=C1\C=CC(F)=C\C1=C\C(=C)F.
What is the InChIKey of (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine?
The InChIKey is RNGNWKAGSIZRFG-BLMPOAMMSA-N. The full InChI is InChI=1S/C11H9F2N/c1-3-14-11-5-4-10(13)7-9(11)6-8(2)12/h3-7H,1-2H2/b9-6-,14-11+.
What are the key properties of (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine?
(6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine has a molecular weight of 193.20 g/mol, XLogP of 3.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (6Z)-N-ethenyl-4-fluoro-6-(2-fluoroprop-2-enylidene)cyclohexa-2,4-dien-1-imine is sourced from PubChem (CID 170142846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).