2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide

C11H12Cl2N2O2 — CID 26890563

IUPAC2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide
SMILESCC(C)C(=O)NNC(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C11H12Cl2N2O2/c1-6(2)10(16)14-15-11(17)7-4-3-5-8(12)9(7)13/h3-6H,1-2H3,(H,14,16)(H,15,17)
InChIKeyPJGWQIMUFNQRJR-UHFFFAOYSA-N
MW275.13 g/mol
LogP2.41
Rot. Bonds2

About 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide

2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide (PubChem CID 26890563) has the molecular formula C11H12Cl2N2O2 and a molecular weight of 275.13 g/mol. Its IUPAC name is 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide.

Molecular Properties

Compound Name2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide
PubChem CID26890563
Molecular FormulaC11H12Cl2N2O2
Molecular Weight275.13 g/mol
Exact Mass274.03
IUPAC Name2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide
SMILESCC(C)C(=O)NNC(=O)c1cccc(Cl)c1Cl
InChIInChI=1S/C11H12Cl2N2O2/c1-6(2)10(16)14-15-11(17)7-4-3-5-8(12)9(7)13/h3-6H,1-2H3,(H,14,16)(H,15,17)
InChIKeyPJGWQIMUFNQRJR-UHFFFAOYSA-N
XLogP2.41
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.13
LogP ≤ 52.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2,3-dichloro-N'-(2-naphthalen-2-yloxypropanoyl)benzohydrazide
CID 43003659
2-chloro-N-[(2S)-1-[2-(2-chlorobenzoyl)hydrazinyl]-1-oxopropan-2-yl]benzamide
CID 2712046
2,3-dichloro-N-[1-[3-(2-methylpropanoylamino)anilino]-1-oxopropan-2-yl]benzamide
CID 55852819
[(2S)-1-(2-benzoylhydrazinyl)-1-oxopropan-2-yl] 2,3-dichlorobenzoate
CID 8871772
2,3-dichloro-N-sulfanylbenzamide
CID 71773851
N-tert-butyl-2,3-dichlorobenzamide
CID 60643074
2,3-dichloro-N'-(3-methoxy-4-propan-2-yloxybenzoyl)benzohydrazide
CID 26655741
2,3-dichloro-N-ethylbenzamide;methane
CID 158305709
N-[2-(aminomethyl)phenyl]-2,3-dichlorobenzamide
CID 64882330
2-[(2,3-dichlorobenzoyl)amino]propanediamide
CID 25465611
2,3-dichloro-N-[1-[2-[2-(2-fluorophenoxy)propanoyl]hydrazinyl]-1-oxopropan-2-yl]benzamide
CID 55741094
2,3-dichloro-N-(4-chloropentyl)benzamide
CID 106129757

Frequently Asked Questions

What is the IUPAC name of 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide?
The IUPAC name of 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide (CID 26890563) is 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide.
What is the SMILES notation for 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide?
The canonical SMILES for 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide is CC(C)C(=O)NNC(=O)c1cccc(Cl)c1Cl.
What is the InChIKey of 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide?
The InChIKey is PJGWQIMUFNQRJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N2O2/c1-6(2)10(16)14-15-11(17)7-4-3-5-8(12)9(7)13/h3-6H,1-2H3,(H,14,16)(H,15,17).
What are the key properties of 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide?
2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide has a molecular weight of 275.13 g/mol, XLogP of 2.41, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dichloro-N'-(2-methylpropanoyl)benzohydrazide is sourced from PubChem (CID 26890563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).