1-butan-2-yl-1-methylhydrazine

C5H14N2 — CID 57056521

IUPAC1-butan-2-yl-1-methylhydrazine
SMILESCCC(C)N(C)N
InChIInChI=1S/C5H14N2/c1-4-5(2)7(3)6/h5H,4,6H2,1-3H3
InChIKeyMZHLGPNSBYQNGS-UHFFFAOYSA-N
MW102.18 g/mol
LogP0.59
Rot. Bonds2

About 1-butan-2-yl-1-methylhydrazine

1-butan-2-yl-1-methylhydrazine (PubChem CID 57056521) has the molecular formula C5H14N2 and a molecular weight of 102.18 g/mol. Its IUPAC name is 1-butan-2-yl-1-methylhydrazine.

Molecular Properties

Compound Name1-butan-2-yl-1-methylhydrazine
PubChem CID57056521
Molecular FormulaC5H14N2
Molecular Weight102.18 g/mol
Exact Mass102.12
IUPAC Name1-butan-2-yl-1-methylhydrazine
SMILESCCC(C)N(C)N
InChIInChI=1S/C5H14N2/c1-4-5(2)7(3)6/h5H,4,6H2,1-3H3
InChIKeyMZHLGPNSBYQNGS-UHFFFAOYSA-N
XLogP0.59
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.18
LogP ≤ 50.59
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'}

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Frequently Asked Questions

What is the IUPAC name of 1-butan-2-yl-1-methylhydrazine?
The IUPAC name of 1-butan-2-yl-1-methylhydrazine (CID 57056521) is 1-butan-2-yl-1-methylhydrazine.
What is the SMILES notation for 1-butan-2-yl-1-methylhydrazine?
The canonical SMILES for 1-butan-2-yl-1-methylhydrazine is CCC(C)N(C)N.
What is the InChIKey of 1-butan-2-yl-1-methylhydrazine?
The InChIKey is MZHLGPNSBYQNGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H14N2/c1-4-5(2)7(3)6/h5H,4,6H2,1-3H3.
What are the key properties of 1-butan-2-yl-1-methylhydrazine?
1-butan-2-yl-1-methylhydrazine has a molecular weight of 102.18 g/mol, XLogP of 0.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butan-2-yl-1-methylhydrazine is sourced from PubChem (CID 57056521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).