1-(2-methylhydrazinyl)propan-2-one

C4H10N2O — CID 59567216

IUPAC1-(2-methylhydrazinyl)propan-2-one
SMILESCNNCC(C)=O
InChIInChI=1S/C4H10N2O/c1-4(7)3-6-5-2/h5-6H,3H2,1-2H3
InChIKeyYIDUGKLQASRTAB-UHFFFAOYSA-N
MW102.14 g/mol
LogP-0.70
Rot. Bonds3

About 1-(2-methylhydrazinyl)propan-2-one

1-(2-methylhydrazinyl)propan-2-one (PubChem CID 59567216) has the molecular formula C4H10N2O and a molecular weight of 102.14 g/mol. Its IUPAC name is 1-(2-methylhydrazinyl)propan-2-one.

Molecular Properties

Compound Name1-(2-methylhydrazinyl)propan-2-one
PubChem CID59567216
Molecular FormulaC4H10N2O
Molecular Weight102.14 g/mol
Exact Mass102.08
IUPAC Name1-(2-methylhydrazinyl)propan-2-one
SMILESCNNCC(C)=O
InChIInChI=1S/C4H10N2O/c1-4(7)3-6-5-2/h5-6H,3H2,1-2H3
InChIKeyYIDUGKLQASRTAB-UHFFFAOYSA-N
XLogP-0.70
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.14
LogP ≤ 5-0.70
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-methylhydrazinyl)propan-2-one?
The IUPAC name of 1-(2-methylhydrazinyl)propan-2-one (CID 59567216) is 1-(2-methylhydrazinyl)propan-2-one.
What is the SMILES notation for 1-(2-methylhydrazinyl)propan-2-one?
The canonical SMILES for 1-(2-methylhydrazinyl)propan-2-one is CNNCC(C)=O.
What is the InChIKey of 1-(2-methylhydrazinyl)propan-2-one?
The InChIKey is YIDUGKLQASRTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N2O/c1-4(7)3-6-5-2/h5-6H,3H2,1-2H3.
What are the key properties of 1-(2-methylhydrazinyl)propan-2-one?
1-(2-methylhydrazinyl)propan-2-one has a molecular weight of 102.14 g/mol, XLogP of -0.70, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylhydrazinyl)propan-2-one is sourced from PubChem (CID 59567216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).