(2Z)-N',4-dimethylhexa-2,5-dienimidamide

C8H14N2 — CID 123486543

IUPAC(2Z)-N',4-dimethylhexa-2,5-dienimidamide
SMILESC=CC(C)/C=C\C(N)=N\C
InChIInChI=1S/C8H14N2/c1-4-7(2)5-6-8(9)10-3/h4-7H,1H2,2-3H3,(H2,9,10)/b6-5-
InChIKeyZGUUIXLYQMLQAW-WAYWQWQTSA-N
MW138.21 g/mol
LogP1.35
Rot. Bonds3

About (2Z)-N',4-dimethylhexa-2,5-dienimidamide

(2Z)-N',4-dimethylhexa-2,5-dienimidamide (PubChem CID 123486543) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is (2Z)-N',4-dimethylhexa-2,5-dienimidamide.

Molecular Properties

Compound Name(2Z)-N',4-dimethylhexa-2,5-dienimidamide
PubChem CID123486543
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name(2Z)-N',4-dimethylhexa-2,5-dienimidamide
SMILESC=CC(C)/C=C\C(N)=N\C
InChIInChI=1S/C8H14N2/c1-4-7(2)5-6-8(9)10-3/h4-7H,1H2,2-3H3,(H2,9,10)/b6-5-
InChIKeyZGUUIXLYQMLQAW-WAYWQWQTSA-N
XLogP1.35
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (2Z)-N',4-dimethylhexa-2,5-dienimidamide?
The IUPAC name of (2Z)-N',4-dimethylhexa-2,5-dienimidamide (CID 123486543) is (2Z)-N',4-dimethylhexa-2,5-dienimidamide.
What is the SMILES notation for (2Z)-N',4-dimethylhexa-2,5-dienimidamide?
The canonical SMILES for (2Z)-N',4-dimethylhexa-2,5-dienimidamide is C=CC(C)/C=C\C(N)=N\C.
What is the InChIKey of (2Z)-N',4-dimethylhexa-2,5-dienimidamide?
The InChIKey is ZGUUIXLYQMLQAW-WAYWQWQTSA-N. The full InChI is InChI=1S/C8H14N2/c1-4-7(2)5-6-8(9)10-3/h4-7H,1H2,2-3H3,(H2,9,10)/b6-5-.
What are the key properties of (2Z)-N',4-dimethylhexa-2,5-dienimidamide?
(2Z)-N',4-dimethylhexa-2,5-dienimidamide has a molecular weight of 138.21 g/mol, XLogP of 1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N',4-dimethylhexa-2,5-dienimidamide is sourced from PubChem (CID 123486543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).