(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine

C8H10F6N2 — CID 59782166

IUPAC(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\N(C)C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H10F6N2/c1-15-5(7(9,10)11)4-6(16(2)3)8(12,13)14/h4H,1-3H3/b6-4-,15-5-
InChIKeyNQDXLWUFEYDJMO-QRRQCYJXSA-N
MW248.17 g/mol
LogP2.63
Rot. Bonds2

About (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine

(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine (PubChem CID 59782166) has the molecular formula C8H10F6N2 and a molecular weight of 248.17 g/mol. Its IUPAC name is (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine.

Molecular Properties

Compound Name(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine
PubChem CID59782166
Molecular FormulaC8H10F6N2
Molecular Weight248.17 g/mol
Exact Mass248.07
IUPAC Name(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine
SMILESC/N=C(/C=C(\N(C)C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H10F6N2/c1-15-5(7(9,10)11)4-6(16(2)3)8(12,13)14/h4H,1-3H3/b6-4-,15-5-
InChIKeyNQDXLWUFEYDJMO-QRRQCYJXSA-N
XLogP2.63
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.17
LogP ≤ 52.63
H-Bond Donors ≤ 50
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)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine?
The IUPAC name of (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine (CID 59782166) is (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine.
What is the SMILES notation for (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine?
The canonical SMILES for (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine is C/N=C(/C=C(\N(C)C)C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine?
The InChIKey is NQDXLWUFEYDJMO-QRRQCYJXSA-N. The full InChI is InChI=1S/C8H10F6N2/c1-15-5(7(9,10)11)4-6(16(2)3)8(12,13)14/h4H,1-3H3/b6-4-,15-5-.
What are the key properties of (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine?
(Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine has a molecular weight of 248.17 g/mol, XLogP of 2.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,1,5,5,5-hexafluoro-N,N-dimethyl-4-methyliminopent-2-en-2-amine is sourced from PubChem (CID 59782166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).