1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine

C9H17FN2 — CID 170144467

IUPAC1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine
SMILESC=C/C(F)=C(\CC)N(C)N(C)C
InChIInChI=1S/C9H17FN2/c1-6-8(10)9(7-2)12(5)11(3)4/h6H,1,7H2,2-5H3/b9-8-
InChIKeyNXYARWCBSGIEFJ-HJWRWDBZSA-N
MW172.25 g/mol
LogP2.17
Rot. Bonds4

About 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine

1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine (PubChem CID 170144467) has the molecular formula C9H17FN2 and a molecular weight of 172.25 g/mol. Its IUPAC name is 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine.

Molecular Properties

Compound Name1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine
PubChem CID170144467
Molecular FormulaC9H17FN2
Molecular Weight172.25 g/mol
Exact Mass172.14
IUPAC Name1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine
SMILESC=C/C(F)=C(\CC)N(C)N(C)C
InChIInChI=1S/C9H17FN2/c1-6-8(10)9(7-2)12(5)11(3)4/h6H,1,7H2,2-5H3/b9-8-
InChIKeyNXYARWCBSGIEFJ-HJWRWDBZSA-N
XLogP2.17
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.25
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine?
The IUPAC name of 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine (CID 170144467) is 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine.
What is the SMILES notation for 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine?
The canonical SMILES for 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine is C=C/C(F)=C(\CC)N(C)N(C)C.
What is the InChIKey of 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine?
The InChIKey is NXYARWCBSGIEFJ-HJWRWDBZSA-N. The full InChI is InChI=1S/C9H17FN2/c1-6-8(10)9(7-2)12(5)11(3)4/h6H,1,7H2,2-5H3/b9-8-.
What are the key properties of 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine?
1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine has a molecular weight of 172.25 g/mol, XLogP of 2.17, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3Z)-4-fluorohexa-3,5-dien-3-yl]-1,2,2-trimethylhydrazine is sourced from PubChem (CID 170144467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).