(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine

C6H11N3 — CID 129266395

IUPAC(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine
SMILESC=N/N=C\C(C)=C(\C)N
InChIInChI=1S/C6H11N3/c1-5(6(2)7)4-9-8-3/h4H,3,7H2,1-2H3/b6-5-,9-4-
InChIKeyBJMMKKHCGSNXEE-HCJFEJOASA-N
MW125.17 g/mol
LogP0.93
Rot. Bonds2

About (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine

(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine (PubChem CID 129266395) has the molecular formula C6H11N3 and a molecular weight of 125.17 g/mol. Its IUPAC name is (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine.

Molecular Properties

Compound Name(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine
PubChem CID129266395
Molecular FormulaC6H11N3
Molecular Weight125.17 g/mol
Exact Mass125.10
IUPAC Name(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine
SMILESC=N/N=C\C(C)=C(\C)N
InChIInChI=1S/C6H11N3/c1-5(6(2)7)4-9-8-3/h4H,3,7H2,1-2H3/b6-5-,9-4-
InChIKeyBJMMKKHCGSNXEE-HCJFEJOASA-N
XLogP0.93
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine?
The IUPAC name of (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine (CID 129266395) is (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine.
What is the SMILES notation for (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine?
The canonical SMILES for (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine is C=N/N=C\C(C)=C(\C)N.
What is the InChIKey of (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine?
The InChIKey is BJMMKKHCGSNXEE-HCJFEJOASA-N. The full InChI is InChI=1S/C6H11N3/c1-5(6(2)7)4-9-8-3/h4H,3,7H2,1-2H3/b6-5-,9-4-.
What are the key properties of (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine?
(Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine has a molecular weight of 125.17 g/mol, XLogP of 0.93, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z,4Z)-3-methyl-4-(methylidenehydrazinylidene)but-2-en-2-amine is sourced from PubChem (CID 129266395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).