6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine

C11H16FN — CID 156800818

IUPAC6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine
SMILESC=CC1=C(C(=C)F)CCCN1CC
InChIInChI=1S/C11H16FN/c1-4-11-10(9(3)12)7-6-8-13(11)5-2/h4H,1,3,5-8H2,2H3
InChIKeyXZRAOPUYENCABO-UHFFFAOYSA-N
MW181.25 g/mol
LogP3.03
Rot. Bonds3

About 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine

6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine (PubChem CID 156800818) has the molecular formula C11H16FN and a molecular weight of 181.25 g/mol. Its IUPAC name is 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine.

Molecular Properties

Compound Name6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine
PubChem CID156800818
Molecular FormulaC11H16FN
Molecular Weight181.25 g/mol
Exact Mass181.13
IUPAC Name6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine
SMILESC=CC1=C(C(=C)F)CCCN1CC
InChIInChI=1S/C11H16FN/c1-4-11-10(9(3)12)7-6-8-13(11)5-2/h4H,1,3,5-8H2,2H3
InChIKeyXZRAOPUYENCABO-UHFFFAOYSA-N
XLogP3.03
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.25
LogP ≤ 53.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-N-(fluoromethyl)-N-hexylcyclohexa-2,4-dien-1-amine
CID 17948295
1-fluoro-N-hexyl-N-methylcyclohexa-2,4-dien-1-amine
CID 17948373
N-butyl-1-fluoro-N-hexylcyclohexa-2,4-dien-1-amine
CID 17948392
N-ethyl-1-fluoro-N-(2-methylpentyl)cyclohexa-2,4-dien-1-amine
CID 23123337
N-butyl-N-ethyl-1-fluorocyclohexa-2,4-dien-1-amine
CID 23123359
1-fluoro-N-hexyl-N-propylcyclohexa-2,4-dien-1-amine
CID 23123430
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(3Z,5E,8Z)-5-fluoro-1,8-dimethyl-2-methylidene-1-azacycloundeca-3,5,8-triene
CID 89299112
7-Fluoro-2-propan-2-yl-1,3,4,5-tetrahydrocyclohepta[c]pyridine
CID 91218244
N-(1-cyclopropylideneethyl)-N-[2-(2-fluorocyclohexa-1,5-dien-1-yl)ethyl]hexa-2,4-dien-3-amine
CID 123404943
1-(3-Fluoro-2-propan-2-ylidenehex-3-enyl)piperidine
CID 123561041
6-(4-fluoropent-2-enylidene)-N,N-dimethylcyclohexa-1,3-dien-1-amine
CID 123629047

Frequently Asked Questions

What is the IUPAC name of 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine?
The IUPAC name of 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine (CID 156800818) is 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine.
What is the SMILES notation for 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine?
The canonical SMILES for 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine is C=CC1=C(C(=C)F)CCCN1CC.
What is the InChIKey of 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine?
The InChIKey is XZRAOPUYENCABO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN/c1-4-11-10(9(3)12)7-6-8-13(11)5-2/h4H,1,3,5-8H2,2H3.
What are the key properties of 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine?
6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine has a molecular weight of 181.25 g/mol, XLogP of 3.03, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethenyl-1-ethyl-5-(1-fluoroethenyl)-3,4-dihydro-2H-pyridine is sourced from PubChem (CID 156800818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).