4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine

C10H14FN — CID 143404568

IUPAC4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine
SMILESC=CC1=C(C=C)CN(C)C(F)C1
InChIInChI=1S/C10H14FN/c1-4-8-6-10(11)12(3)7-9(8)5-2/h4-5,10H,1-2,6-7H2,3H3
InChIKeyAPHVOLKFXWRIST-UHFFFAOYSA-N
MW167.23 g/mol
LogP2.29
Rot. Bonds2

About 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine

4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine (PubChem CID 143404568) has the molecular formula C10H14FN and a molecular weight of 167.23 g/mol. Its IUPAC name is 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine.

Molecular Properties

Compound Name4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine
PubChem CID143404568
Molecular FormulaC10H14FN
Molecular Weight167.23 g/mol
Exact Mass167.11
IUPAC Name4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine
SMILESC=CC1=C(C=C)CN(C)C(F)C1
InChIInChI=1S/C10H14FN/c1-4-8-6-10(11)12(3)7-9(8)5-2/h4-5,10H,1-2,6-7H2,3H3
InChIKeyAPHVOLKFXWRIST-UHFFFAOYSA-N
XLogP2.29
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.23
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Related Compounds

1-Methyl-4-vinyl-1,2,3,6-tetrahydro-pyridine
CID 10036134
1-fluoro-N-methyl-N-propylcyclohexa-2,4-dien-1-amine
CID 22637871
N-butyl-1-fluoro-N-(fluoromethyl)cyclohexa-2,4-dien-1-amine
CID 22638271
N-butyl-N-ethyl-1-fluorocyclohexa-2,4-dien-1-amine
CID 23123359
1-(3-fluorocyclohexa-2,4-dien-1-yl)-N,N-dimethylmethanamine
CID 68393518
1-(2-fluoroethyl)-4-methyl-3,6-dihydro-2H-pyridine
CID 88589110
(2E)-2-[(Z)-3-fluoroprop-1-enyl]-N,N-dimethylpenta-2,4-dien-1-amine
CID 89502908
7-Fluoro-2-propan-2-yl-1,3,4,5-tetrahydrocyclohepta[c]pyridine
CID 91218244
3-fluoro-1,4-dimethyl-3,6-dihydro-2H-pyridine
CID 117936380
1-(5-fluorocyclohexa-1,5-dien-1-yl)-N,N-dimethylmethanamine
CID 129059918
1-(5,6-difluorocyclohexa-1,5-dien-1-yl)-N,N-dimethylmethanamine
CID 130243433
(2Z,6Z,7E)-N-ethyl-6-ethylidene-9-fluoro-N,2-dimethyl-4-methylidenenona-2,7-dien-1-amine
CID 130317615

Frequently Asked Questions

What is the IUPAC name of 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine?
The IUPAC name of 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine (CID 143404568) is 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine.
What is the SMILES notation for 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine?
The canonical SMILES for 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine is C=CC1=C(C=C)CN(C)C(F)C1.
What is the InChIKey of 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine?
The InChIKey is APHVOLKFXWRIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14FN/c1-4-8-6-10(11)12(3)7-9(8)5-2/h4-5,10H,1-2,6-7H2,3H3.
What are the key properties of 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine?
4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine has a molecular weight of 167.23 g/mol, XLogP of 2.29, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-bis(ethenyl)-2-fluoro-1-methyl-3,6-dihydro-2H-pyridine is sourced from PubChem (CID 143404568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).