(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine

C10H14F4N2 — CID 167172070

IUPAC(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine
SMILESC=N/C=C(\C=N\C)CCC(C)(F)C(F)(F)F
InChIInChI=1S/C10H14F4N2/c1-9(11,10(12,13)14)5-4-8(6-15-2)7-16-3/h6-7H,2,4-5H2,1,3H3/b8-6-,16-7+
InChIKeyZFXIZIFARXGUDJ-JVTGKPJRSA-N
MW238.23 g/mol
LogP3.34
Rot. Bonds5

About (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine

(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine (PubChem CID 167172070) has the molecular formula C10H14F4N2 and a molecular weight of 238.23 g/mol. Its IUPAC name is (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine.

Molecular Properties

Compound Name(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine
PubChem CID167172070
Molecular FormulaC10H14F4N2
Molecular Weight238.23 g/mol
Exact Mass238.11
IUPAC Name(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine
SMILESC=N/C=C(\C=N\C)CCC(C)(F)C(F)(F)F
InChIInChI=1S/C10H14F4N2/c1-9(11,10(12,13)14)5-4-8(6-15-2)7-16-3/h6-7H,2,4-5H2,1,3H3/b8-6-,16-7+
InChIKeyZFXIZIFARXGUDJ-JVTGKPJRSA-N
XLogP3.34
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.23
LogP ≤ 53.34
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 (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine?
The IUPAC name of (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine (CID 167172070) is (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine.
What is the SMILES notation for (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine?
The canonical SMILES for (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine is C=N/C=C(\C=N\C)CCC(C)(F)C(F)(F)F.
What is the InChIKey of (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine?
The InChIKey is ZFXIZIFARXGUDJ-JVTGKPJRSA-N. The full InChI is InChI=1S/C10H14F4N2/c1-9(11,10(12,13)14)5-4-8(6-15-2)7-16-3/h6-7H,2,4-5H2,1,3H3/b8-6-,16-7+.
What are the key properties of (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine?
(2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine has a molecular weight of 238.23 g/mol, XLogP of 3.34, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-5,6,6,6-tetrafluoro-N,5-dimethyl-2-[(methylideneamino)methylidene]hexan-1-imine is sourced from PubChem (CID 167172070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).