1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine

C7H14N2 — CID 166780932

IUPAC1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine
SMILESC=C(/C=C\CC)NNC
InChIInChI=1S/C7H14N2/c1-4-5-6-7(2)9-8-3/h5-6,8-9H,2,4H2,1,3H3/b6-5-
InChIKeyJWQXIPRRNFDPDJ-WAYWQWQTSA-N
MW126.20 g/mol
LogP1.19
Rot. Bonds4

About 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine

1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine (PubChem CID 166780932) has the molecular formula C7H14N2 and a molecular weight of 126.20 g/mol. Its IUPAC name is 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine.

Molecular Properties

Compound Name1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine
PubChem CID166780932
Molecular FormulaC7H14N2
Molecular Weight126.20 g/mol
Exact Mass126.12
IUPAC Name1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine
SMILESC=C(/C=C\CC)NNC
InChIInChI=1S/C7H14N2/c1-4-5-6-7(2)9-8-3/h5-6,8-9H,2,4H2,1,3H3/b6-5-
InChIKeyJWQXIPRRNFDPDJ-WAYWQWQTSA-N
XLogP1.19
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine?
The IUPAC name of 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine (CID 166780932) is 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine.
What is the SMILES notation for 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine?
The canonical SMILES for 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine is C=C(/C=C\CC)NNC.
What is the InChIKey of 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine?
The InChIKey is JWQXIPRRNFDPDJ-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H14N2/c1-4-5-6-7(2)9-8-3/h5-6,8-9H,2,4H2,1,3H3/b6-5-.
What are the key properties of 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine?
1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine has a molecular weight of 126.20 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3Z)-hexa-1,3-dien-2-yl]-2-methylhydrazine is sourced from PubChem (CID 166780932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).