(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine

C6H10F3N3 — CID 165138667

IUPAC(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine
SMILESC=CC/C(NN)=C(/N)C(F)(F)F
InChIInChI=1S/C6H10F3N3/c1-2-3-4(12-11)5(10)6(7,8)9/h2,12H,1,3,10-11H2/b5-4-
InChIKeyYILNEZKSMNSKSO-PLNGDYQASA-N
MW181.16 g/mol
LogP0.76
Rot. Bonds3

About (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine

(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine (PubChem CID 165138667) has the molecular formula C6H10F3N3 and a molecular weight of 181.16 g/mol. Its IUPAC name is (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine.

Molecular Properties

Compound Name(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine
PubChem CID165138667
Molecular FormulaC6H10F3N3
Molecular Weight181.16 g/mol
Exact Mass181.08
IUPAC Name(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine
SMILESC=CC/C(NN)=C(/N)C(F)(F)F
InChIInChI=1S/C6H10F3N3/c1-2-3-4(12-11)5(10)6(7,8)9/h2,12H,1,3,10-11H2/b5-4-
InChIKeyYILNEZKSMNSKSO-PLNGDYQASA-N
XLogP0.76
TPSA64.07 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.16
LogP ≤ 50.76
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

[(E)-1,1,1-trifluorohex-2-en-2-yl]hydrazine
CID 89225194
[(3Z)-5-(trifluoromethyl)hexa-1,3,5-trien-2-yl]hydrazine
CID 143936287
1-methyl-2-[(Z)-5,5,5-trifluoropent-2-en-2-yl]hydrazine
CID 173804973
(4,4-Difluorocyclohexa-1,5-dien-1-yl)hydrazine
CID 154521242
[(2Z)-hexa-2,5-dien-2-yl]hydrazine
CID 170067044

Frequently Asked Questions

What is the IUPAC name of (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine?
The IUPAC name of (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine (CID 165138667) is (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine.
What is the SMILES notation for (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine?
The canonical SMILES for (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine is C=CC/C(NN)=C(/N)C(F)(F)F.
What is the InChIKey of (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine?
The InChIKey is YILNEZKSMNSKSO-PLNGDYQASA-N. The full InChI is InChI=1S/C6H10F3N3/c1-2-3-4(12-11)5(10)6(7,8)9/h2,12H,1,3,10-11H2/b5-4-.
What are the key properties of (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine?
(2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine has a molecular weight of 181.16 g/mol, XLogP of 0.76, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-1,1,1-trifluoro-3-hydrazinylhexa-2,5-dien-2-amine is sourced from PubChem (CID 165138667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).