2,2-dichloro-N',N'-diethylacetohydrazide

C6H12Cl2N2O — CID 174663209

IUPAC2,2-dichloro-N',N'-diethylacetohydrazide
SMILESCCN(CC)NC(=O)C(Cl)Cl
InChIInChI=1S/C6H12Cl2N2O/c1-3-10(4-2)9-6(11)5(7)8/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyMJBKLKONCPSQLE-UHFFFAOYSA-N
MW199.08 g/mol
LogP1.16
Rot. Bonds4

About 2,2-dichloro-N',N'-diethylacetohydrazide

2,2-dichloro-N',N'-diethylacetohydrazide (PubChem CID 174663209) has the molecular formula C6H12Cl2N2O and a molecular weight of 199.08 g/mol. Its IUPAC name is 2,2-dichloro-N',N'-diethylacetohydrazide.

Molecular Properties

Compound Name2,2-dichloro-N',N'-diethylacetohydrazide
PubChem CID174663209
Molecular FormulaC6H12Cl2N2O
Molecular Weight199.08 g/mol
Exact Mass198.03
IUPAC Name2,2-dichloro-N',N'-diethylacetohydrazide
SMILESCCN(CC)NC(=O)C(Cl)Cl
InChIInChI=1S/C6H12Cl2N2O/c1-3-10(4-2)9-6(11)5(7)8/h5H,3-4H2,1-2H3,(H,9,11)
InChIKeyMJBKLKONCPSQLE-UHFFFAOYSA-N
XLogP1.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.08
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2,2-dichloro-N',N'-diethylacetohydrazide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

copper bis(N-(diethylamino)carbamothioate)
CID 174855196
2,2-dichloro-N,N-diethylacetamide
CID 141409453
2,2-dichloro-N-(1,1-dihydroxypropyl)acetamide
CID 139215553
N,2,2-trichloro-N-ethylacetamide
CID 88809029
2,2-dichloro-N-(2-hydroxyethyl)acetamide
CID 5228722
2,2-dichloro-N-hydroxyacetamide
CID 59715454
2,2-dichloro-N-(hydroxymethyl)acetamide
CID 12832764
N',N'-diethylhexadecanehydrazide
CID 141450549
2-(2,2-diethylhydrazinyl)propanoic acid
CID 175089566
2,2-dichloro-N,N-diethylacetamide;N,N-diethylacetamide
CID 174887176
N'-ethyl-N',2-dimethylbutanehydrazide
CID 131211821
2-[carboxymethyl-(2-methylpropanoylamino)amino]acetic acid
CID 22373803

Frequently Asked Questions

What is the IUPAC name of 2,2-dichloro-N',N'-diethylacetohydrazide?
The IUPAC name of 2,2-dichloro-N',N'-diethylacetohydrazide (CID 174663209) is 2,2-dichloro-N',N'-diethylacetohydrazide.
What is the SMILES notation for 2,2-dichloro-N',N'-diethylacetohydrazide?
The canonical SMILES for 2,2-dichloro-N',N'-diethylacetohydrazide is CCN(CC)NC(=O)C(Cl)Cl.
What is the InChIKey of 2,2-dichloro-N',N'-diethylacetohydrazide?
The InChIKey is MJBKLKONCPSQLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12Cl2N2O/c1-3-10(4-2)9-6(11)5(7)8/h5H,3-4H2,1-2H3,(H,9,11).
What are the key properties of 2,2-dichloro-N',N'-diethylacetohydrazide?
2,2-dichloro-N',N'-diethylacetohydrazide has a molecular weight of 199.08 g/mol, XLogP of 1.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dichloro-N',N'-diethylacetohydrazide is sourced from PubChem (CID 174663209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).