[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine

C13H19ClN2 — CID 105310083

IUPAC[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine
SMILESCc1ccc(C(CC2CCC2)NN)cc1Cl
InChIInChI=1S/C13H19ClN2/c1-9-5-6-11(8-12(9)14)13(16-15)7-10-3-2-4-10/h5-6,8,10,13,16H,2-4,7,15H2,1H3
InChIKeyHSYFETNDKCILLC-UHFFFAOYSA-N
MW238.76 g/mol
LogP3.34
Rot. Bonds4

About [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine

[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine (PubChem CID 105310083) has the molecular formula C13H19ClN2 and a molecular weight of 238.76 g/mol. Its IUPAC name is [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine
PubChem CID105310083
Molecular FormulaC13H19ClN2
Molecular Weight238.76 g/mol
Exact Mass238.12
IUPAC Name[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine
SMILESCc1ccc(C(CC2CCC2)NN)cc1Cl
InChIInChI=1S/C13H19ClN2/c1-9-5-6-11(8-12(9)14)13(16-15)7-10-3-2-4-10/h5-6,8,10,13,16H,2-4,7,15H2,1H3
InChIKeyHSYFETNDKCILLC-UHFFFAOYSA-N
XLogP3.34
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.76
LogP ≤ 53.34
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'}

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Related Compounds

1-(3-chloro-4-methylphenyl)-2-cyclohexyl-N-methylethanamine
CID 115842241
[1-(4-chloro-3-methylphenyl)-2-cyclopropylethyl]hydrazine
CID 105311042
[2-cyclopropyl-1-(3,4-dimethylphenyl)ethyl]hydrazine
CID 105254156
[1-(3-chloro-4-methylphenyl)-3-cyclopropylpropyl]hydrazine
CID 105315126
1-(3-chloro-4-methylphenyl)-2-cycloheptylethanol
CID 107562179
2-cyclobutyl-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 81491759
[2-cyclobutyl-1-(3,4-dimethoxyphenyl)ethyl]hydrazine
CID 105192203
[(3-chloro-4-methylphenyl)-(4-ethylcyclohexyl)methyl]hydrazine
CID 105313068
[1-(3-chloro-4-methylphenyl)-3-ethylpentyl]hydrazine
CID 105331071
[1-(3-chloro-4-methylphenyl)-4,4,4-trifluorobutyl]hydrazine
CID 105313900
[1-(4-chlorophenyl)-2-cyclopropylethyl]hydrazine
CID 105193196
1-(3-chloro-4-iodophenyl)-2-cyclobutyl-N-methylethanamine
CID 103215395

Frequently Asked Questions

What is the IUPAC name of [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine (CID 105310083) is [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine is Cc1ccc(C(CC2CCC2)NN)cc1Cl.
What is the InChIKey of [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine?
The InChIKey is HSYFETNDKCILLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19ClN2/c1-9-5-6-11(8-12(9)14)13(16-15)7-10-3-2-4-10/h5-6,8,10,13,16H,2-4,7,15H2,1H3.
What are the key properties of [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine?
[1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine has a molecular weight of 238.76 g/mol, XLogP of 3.34, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-methylphenyl)-2-cyclobutylethyl]hydrazine is sourced from PubChem (CID 105310083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).