N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide

C11H12Cl2N2O — CID 2813079

IUPACN'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide
SMILESO=C(NNc1cc(Cl)cc(Cl)c1)C1CCC1
InChIInChI=1S/C11H12Cl2N2O/c12-8-4-9(13)6-10(5-8)14-15-11(16)7-2-1-3-7/h4-7,14H,1-3H2,(H,15,16)
InChIKeyUFGWYXCIRZSPDF-UHFFFAOYSA-N
MW259.14 g/mol
LogP3.24
Rot. Bonds3

About N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide

N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide (PubChem CID 2813079) has the molecular formula C11H12Cl2N2O and a molecular weight of 259.14 g/mol. Its IUPAC name is N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide.

Molecular Properties

Compound NameN'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide
PubChem CID2813079
Molecular FormulaC11H12Cl2N2O
Molecular Weight259.14 g/mol
Exact Mass258.03
IUPAC NameN'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide
SMILESO=C(NNc1cc(Cl)cc(Cl)c1)C1CCC1
InChIInChI=1S/C11H12Cl2N2O/c12-8-4-9(13)6-10(5-8)14-15-11(16)7-2-1-3-7/h4-7,14H,1-3H2,(H,15,16)
InChIKeyUFGWYXCIRZSPDF-UHFFFAOYSA-N
XLogP3.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.14
LogP ≤ 53.24
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

N'-(2,5-dichlorophenyl)cyclobutanecarbohydrazide
CID 2811011
N'-(4-chlorophenyl)cyclobutanecarbohydrazide
CID 2812580
N'-(2,6-dichlorophenyl)cyclobutanecarbohydrazide
CID 2812889
N'-(2,4,6-trichlorophenyl)cyclobutanecarbohydrazide
CID 2418684
N'-(3-Chlorophenyl)acetohydrazide
CID 603541
N'-(3-chlorophenyl)cyclohexanecarbohydrazide
CID 2812495
Propanehydrazide, N2-(4-chlorophenyl)-
CID 588325
Butyric N2-(4-chlorophenyl)hydrazide
CID 5152318
Carboxylcyanide m-chlorophenylhydrazone
CID 165047892
N'-(3-chloro-5-fluorophenyl)-2-cyclopropylacetohydrazide
CID 67066739
N'-(3-chloro-5-fluorophenyl)-3,3-dimethylbutanehydrazide
CID 67066743
N'-(3-chloro-2-fluorophenyl)acetohydrazide
CID 71254781

Frequently Asked Questions

What is the IUPAC name of N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide?
The IUPAC name of N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide (CID 2813079) is N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide.
What is the SMILES notation for N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide?
The canonical SMILES for N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide is O=C(NNc1cc(Cl)cc(Cl)c1)C1CCC1.
What is the InChIKey of N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide?
The InChIKey is UFGWYXCIRZSPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12Cl2N2O/c12-8-4-9(13)6-10(5-8)14-15-11(16)7-2-1-3-7/h4-7,14H,1-3H2,(H,15,16).
What are the key properties of N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide?
N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide has a molecular weight of 259.14 g/mol, XLogP of 3.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3,5-dichlorophenyl)cyclobutanecarbohydrazide is sourced from PubChem (CID 2813079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).