[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine

C14H21ClN2 — CID 105235752

IUPAC[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine
SMILESNNC(CCCCl)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H21ClN2/c15-10-2-5-14(17-16)13-8-6-12(7-9-13)11-3-1-4-11/h6-9,11,14,17H,1-5,10,16H2
InChIKeyQVTYIXCCKYEXPY-UHFFFAOYSA-N
MW252.79 g/mol
LogP3.48
Rot. Bonds6

About [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine

[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine (PubChem CID 105235752) has the molecular formula C14H21ClN2 and a molecular weight of 252.79 g/mol. Its IUPAC name is [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine
PubChem CID105235752
Molecular FormulaC14H21ClN2
Molecular Weight252.79 g/mol
Exact Mass252.14
IUPAC Name[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine
SMILESNNC(CCCCl)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H21ClN2/c15-10-2-5-14(17-16)13-8-6-12(7-9-13)11-3-1-4-11/h6-9,11,14,17H,1-5,10,16H2
InChIKeyQVTYIXCCKYEXPY-UHFFFAOYSA-N
XLogP3.48
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.79
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[1-(4-cyclobutylphenyl)-2-cycloheptylethyl]hydrazine
CID 105338120
[1-(4-cyclobutylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105338158
[4-chloro-1-(4-phenylphenyl)butyl]hydrazine
CID 105235525
[1-(4-cyclobutylphenyl)-2-(4-fluorophenyl)ethyl]hydrazine
CID 105198396
[1-(4-cyclobutylphenyl)-2-cyclohexylsulfanylethyl]hydrazine
CID 105227909
[1-(4-cyclobutylphenyl)-2-(2-methylphenyl)ethyl]hydrazine
CID 105208445
[1-(4-cyclobutylphenyl)-2-(1-methoxycyclobutyl)ethyl]hydrazine
CID 103560610
1-(3-cyclobutylphenyl)nonylhydrazine
CID 105342031
1-(4-cyclohexylphenyl)-N-methylpentan-1-amine
CID 43484983
[4-chloro-1-(4-propoxyphenyl)butyl]hydrazine
CID 105235769
1-(4-cyclobutylphenyl)-2-cyclopentyl-N-methylethanamine
CID 105045068
[1-(4-cyclobutylphenyl)-2-ethylbutyl]hydrazine
CID 105338100

Frequently Asked Questions

What is the IUPAC name of [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine?
The IUPAC name of [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine (CID 105235752) is [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine.
What is the SMILES notation for [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine?
The canonical SMILES for [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine is NNC(CCCCl)c1ccc(C2CCC2)cc1.
What is the InChIKey of [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine?
The InChIKey is QVTYIXCCKYEXPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21ClN2/c15-10-2-5-14(17-16)13-8-6-12(7-9-13)11-3-1-4-11/h6-9,11,14,17H,1-5,10,16H2.
What are the key properties of [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine?
[4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine has a molecular weight of 252.79 g/mol, XLogP of 3.48, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-chloro-1-(4-cyclobutylphenyl)butyl]hydrazine is sourced from PubChem (CID 105235752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).