1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine

C6H12N2 — CID 143245831

IUPAC1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine
SMILESC=C/C=C(\C)N(C)N
InChIInChI=1S/C6H12N2/c1-4-5-6(2)8(3)7/h4-5H,1,7H2,2-3H3/b6-5+
InChIKeyOTCHNJZTDCJQGL-AATRIKPKSA-N
MW112.18 g/mol
LogP0.88
Rot. Bonds2

About 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine

1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine (PubChem CID 143245831) has the molecular formula C6H12N2 and a molecular weight of 112.18 g/mol. Its IUPAC name is 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine.

Molecular Properties

Compound Name1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine
PubChem CID143245831
Molecular FormulaC6H12N2
Molecular Weight112.18 g/mol
Exact Mass112.10
IUPAC Name1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine
SMILESC=C/C=C(\C)N(C)N
InChIInChI=1S/C6H12N2/c1-4-5-6(2)8(3)7/h4-5H,1,7H2,2-3H3/b6-5+
InChIKeyOTCHNJZTDCJQGL-AATRIKPKSA-N
XLogP0.88
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.18
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'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-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine?
The IUPAC name of 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine (CID 143245831) is 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine.
What is the SMILES notation for 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine?
The canonical SMILES for 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine is C=C/C=C(\C)N(C)N.
What is the InChIKey of 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine?
The InChIKey is OTCHNJZTDCJQGL-AATRIKPKSA-N. The full InChI is InChI=1S/C6H12N2/c1-4-5-6(2)8(3)7/h4-5H,1,7H2,2-3H3/b6-5+.
What are the key properties of 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine?
1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine has a molecular weight of 112.18 g/mol, XLogP of 0.88, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1-[(2E)-penta-2,4-dien-2-yl]hydrazine is sourced from PubChem (CID 143245831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).