[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine

C11H16Cl2N2 — CID 105198986

IUPAC[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)c1cccc(Cl)c1Cl
InChIInChI=1S/C11H16Cl2N2/c1-7(2)6-10(15-14)8-4-3-5-9(12)11(8)13/h3-5,7,10,15H,6,14H2,1-2H3
InChIKeyZBRSGIVEUQDXSC-UHFFFAOYSA-N
MW247.17 g/mol
LogP3.54
Rot. Bonds4

About [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine

[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine (PubChem CID 105198986) has the molecular formula C11H16Cl2N2 and a molecular weight of 247.17 g/mol. Its IUPAC name is [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine
PubChem CID105198986
Molecular FormulaC11H16Cl2N2
Molecular Weight247.17 g/mol
Exact Mass246.07
IUPAC Name[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine
SMILESCC(C)CC(NN)c1cccc(Cl)c1Cl
InChIInChI=1S/C11H16Cl2N2/c1-7(2)6-10(15-14)8-4-3-5-9(12)11(8)13/h3-5,7,10,15H,6,14H2,1-2H3
InChIKeyZBRSGIVEUQDXSC-UHFFFAOYSA-N
XLogP3.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.17
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine 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

[1-(2,3-dichlorophenyl)-3-methylhexyl]hydrazine
CID 105298136
1-(2,3-dichlorophenyl)-N-ethyl-3-methylbutan-1-amine
CID 63413278
1-(2,3-dichlorophenyl)-3-methylbutan-1-ol
CID 62789609
[1-(2,3-dichlorophenyl)-2-pyridin-4-ylethyl]hydrazine
CID 105212439
(1S)-1-(2,3-dichlorophenyl)-N-methylethane-1,2-diamine
CID 94343262
[1-(2-fluorophenyl)-3-methylbutyl]hydrazine
CID 105198906
[1-(2-bromophenyl)-3-methylbutyl]hydrazine
CID 105208508
[1-(2,3-dichlorophenyl)-2-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105215164
[1-(2,3-dichlorophenyl)-2-(3-ethoxycyclobutyl)ethyl]hydrazine
CID 103170505
(1S,2R)-1-amino-1-(2,3-dichlorophenyl)-4-methylpentan-2-ol;hydrochloride
CID 171162648
2-(aminomethyl)-1-(2,3-dichlorophenyl)-4-methylpentan-1-ol
CID 65187721
[1-(2,3-dichlorophenyl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105214246

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine?
The IUPAC name of [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine (CID 105198986) is [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine.
What is the SMILES notation for [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine?
The canonical SMILES for [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine is CC(C)CC(NN)c1cccc(Cl)c1Cl.
What is the InChIKey of [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine?
The InChIKey is ZBRSGIVEUQDXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16Cl2N2/c1-7(2)6-10(15-14)8-4-3-5-9(12)11(8)13/h3-5,7,10,15H,6,14H2,1-2H3.
What are the key properties of [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine?
[1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine has a molecular weight of 247.17 g/mol, XLogP of 3.54, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dichlorophenyl)-3-methylbutyl]hydrazine is sourced from PubChem (CID 105198986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).