butan-2-ylhydrazine

C4H12N2 — CID 547690

IUPACbutan-2-ylhydrazine
SMILESCCC(C)NN
InChIInChI=1S/C4H12N2/c1-3-4(2)6-5/h4,6H,3,5H2,1-2H3
InChIKeySFSUYFSIKDDLOL-UHFFFAOYSA-N
MW88.15 g/mol
LogP0.25
Rot. Bonds2

About butan-2-ylhydrazine

butan-2-ylhydrazine (PubChem CID 547690) has the molecular formula C4H12N2 and a molecular weight of 88.15 g/mol. Its IUPAC name is butan-2-ylhydrazine.

Molecular Properties

Compound Namebutan-2-ylhydrazine
PubChem CID547690
Molecular FormulaC4H12N2
Molecular Weight88.15 g/mol
Exact Mass88.10
IUPAC Namebutan-2-ylhydrazine
SMILESCCC(C)NN
InChIInChI=1S/C4H12N2/c1-3-4(2)6-5/h4,6H,3,5H2,1-2H3
InChIKeySFSUYFSIKDDLOL-UHFFFAOYSA-N
XLogP0.25
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50088.15
LogP ≤ 50.25
H-Bond Donors ≤ 52
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 butan-2-ylhydrazine?
The IUPAC name of butan-2-ylhydrazine (CID 547690) is butan-2-ylhydrazine.
What is the SMILES notation for butan-2-ylhydrazine?
The canonical SMILES for butan-2-ylhydrazine is CCC(C)NN.
What is the InChIKey of butan-2-ylhydrazine?
The InChIKey is SFSUYFSIKDDLOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N2/c1-3-4(2)6-5/h4,6H,3,5H2,1-2H3.
What are the key properties of butan-2-ylhydrazine?
butan-2-ylhydrazine has a molecular weight of 88.15 g/mol, XLogP of 0.25, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butan-2-ylhydrazine is sourced from PubChem (CID 547690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).