[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine

C10H17FN2 — CID 163665190

IUPAC[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine
SMILESC=C/C=C(\C=C(/C)F)C(CC)NN
InChIInChI=1S/C10H17FN2/c1-4-6-9(7-8(3)11)10(5-2)13-12/h4,6-7,10,13H,1,5,12H2,2-3H3/b8-7+,9-6+
InChIKeyIXURCQDTPKJKOF-KHHFIZIMSA-N
MW184.26 g/mol
LogP2.21
Rot. Bonds5

About [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine

[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine (PubChem CID 163665190) has the molecular formula C10H17FN2 and a molecular weight of 184.26 g/mol. Its IUPAC name is [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine.

Molecular Properties

Compound Name[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine
PubChem CID163665190
Molecular FormulaC10H17FN2
Molecular Weight184.26 g/mol
Exact Mass184.14
IUPAC Name[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine
SMILESC=C/C=C(\C=C(/C)F)C(CC)NN
InChIInChI=1S/C10H17FN2/c1-4-6-9(7-8(3)11)10(5-2)13-12/h4,6-7,10,13H,1,5,12H2,2-3H3/b8-7+,9-6+
InChIKeyIXURCQDTPKJKOF-KHHFIZIMSA-N
XLogP2.21
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.26
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

(4-Fluorocyclohexa-2,4-dien-1-yl)hydrazine
CID 70318660
(2-Fluoro-3-methylidenecyclohexa-1,5-dien-1-yl)methylhydrazine
CID 123304342
(6E)-7-fluoro-5-methylidenenona-1,6-dien-4-amine
CID 126537665
(4-Fluoro-3,6-dimethylcyclohexa-2,4-dien-1-yl)hydrazine
CID 134385712
1-[(Z)-7,7-difluoro-3-methylidenehept-4-en-2-yl]-2-methylhydrazine
CID 155273413
(2-Fluorocyclohexa-2,4-dien-1-yl)hydrazine
CID 163845779
1-[(4Z,6Z)-6-chloro-4-ethynyl-7-fluoroocta-4,6-dien-3-yl]-2-methylhydrazine
CID 170002107
1-(2-fluoroethyl)-2-[(Z)-2-methylidenepent-3-enyl]hydrazine
CID 170076809
1-(2-Fluoroethyl)-2-(2-methylidenepent-3-enyl)hydrazine
CID 174096071
3-[(3E,5E)-5-fluorohepta-1,3,5-trien-3-yl]-2,3-dihydro-1H-pyrazole
CID 177982660
(7,7,7-Trifluoro-2-methylhept-2-en-4-yl)hydrazine
CID 105249101
6-Fluoro-1,2,3,8a-tetrahydrocinnoline
CID 133062589

Frequently Asked Questions

What is the IUPAC name of [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine?
The IUPAC name of [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine (CID 163665190) is [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine.
What is the SMILES notation for [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine?
The canonical SMILES for [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine is C=C/C=C(\C=C(/C)F)C(CC)NN.
What is the InChIKey of [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine?
The InChIKey is IXURCQDTPKJKOF-KHHFIZIMSA-N. The full InChI is InChI=1S/C10H17FN2/c1-4-6-9(7-8(3)11)10(5-2)13-12/h4,6-7,10,13H,1,5,12H2,2-3H3/b8-7+,9-6+.
What are the key properties of [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine?
[(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine has a molecular weight of 184.26 g/mol, XLogP of 2.21, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4E)-4-[(E)-2-fluoroprop-1-enyl]hepta-4,6-dien-3-yl]hydrazine is sourced from PubChem (CID 163665190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).