(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine

C6H8F4N2 — CID 118408959

IUPAC(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\N)C(F)F)C(F)F
InChIInChI=1S/C6H8F4N2/c1-12-4(6(9)10)2-3(11)5(7)8/h2,5-6H,11H2,1H3/b3-2-,12-4-
InChIKeyRIJGNRPWMCBCMZ-HLKZZCHESA-N
MW184.14 g/mol
LogP1.43
Rot. Bonds3

About (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine

(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine (PubChem CID 118408959) has the molecular formula C6H8F4N2 and a molecular weight of 184.14 g/mol. Its IUPAC name is (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine
PubChem CID118408959
Molecular FormulaC6H8F4N2
Molecular Weight184.14 g/mol
Exact Mass184.06
IUPAC Name(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\N)C(F)F)C(F)F
InChIInChI=1S/C6H8F4N2/c1-12-4(6(9)10)2-3(11)5(7)8/h2,5-6H,11H2,1H3/b3-2-,12-4-
InChIKeyRIJGNRPWMCBCMZ-HLKZZCHESA-N
XLogP1.43
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.14
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine?
The IUPAC name of (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine (CID 118408959) is (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine.
What is the SMILES notation for (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine?
The canonical SMILES for (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine is C/N=C(/C=C(\N)C(F)F)C(F)F.
What is the InChIKey of (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine?
The InChIKey is RIJGNRPWMCBCMZ-HLKZZCHESA-N. The full InChI is InChI=1S/C6H8F4N2/c1-12-4(6(9)10)2-3(11)5(7)8/h2,5-6H,11H2,1H3/b3-2-,12-4-.
What are the key properties of (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine?
(Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine has a molecular weight of 184.14 g/mol, XLogP of 1.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,5,5-tetrafluoro-4-methyliminopent-2-en-2-amine is sourced from PubChem (CID 118408959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).