1,2-dimethylhydrazine;propan-2-one

C5H14N2O — CID 160687322

IUPAC1,2-dimethylhydrazine;propan-2-one
SMILESCC(C)=O.CNNC
InChIInChI=1S/C3H6O.C2H8N2/c1-3(2)4;1-3-4-2/h1-2H3;3-4H,1-2H3
InChIKeyROXYXGIFXBCYAB-UHFFFAOYSA-N
MW118.18 g/mol
LogP-0.06
Rot. Bonds1

About 1,2-dimethylhydrazine;propan-2-one

1,2-dimethylhydrazine;propan-2-one (PubChem CID 160687322) has the molecular formula C5H14N2O and a molecular weight of 118.18 g/mol. Its IUPAC name is 1,2-dimethylhydrazine;propan-2-one.

Molecular Properties

Compound Name1,2-dimethylhydrazine;propan-2-one
PubChem CID160687322
Molecular FormulaC5H14N2O
Molecular Weight118.18 g/mol
Exact Mass118.11
IUPAC Name1,2-dimethylhydrazine;propan-2-one
SMILESCC(C)=O.CNNC
InChIInChI=1S/C3H6O.C2H8N2/c1-3(2)4;1-3-4-2/h1-2H3;3-4H,1-2H3
InChIKeyROXYXGIFXBCYAB-UHFFFAOYSA-N
XLogP-0.06
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500118.18
LogP ≤ 5-0.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,2-dimethylhydrazine;propan-2-one?
The IUPAC name of 1,2-dimethylhydrazine;propan-2-one (CID 160687322) is 1,2-dimethylhydrazine;propan-2-one.
What is the SMILES notation for 1,2-dimethylhydrazine;propan-2-one?
The canonical SMILES for 1,2-dimethylhydrazine;propan-2-one is CC(C)=O.CNNC.
What is the InChIKey of 1,2-dimethylhydrazine;propan-2-one?
The InChIKey is ROXYXGIFXBCYAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6O.C2H8N2/c1-3(2)4;1-3-4-2/h1-2H3;3-4H,1-2H3.
What are the key properties of 1,2-dimethylhydrazine;propan-2-one?
1,2-dimethylhydrazine;propan-2-one has a molecular weight of 118.18 g/mol, XLogP of -0.06, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethylhydrazine;propan-2-one is sourced from PubChem (CID 160687322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).