[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine

C11H16ClFN2 — CID 105325664

IUPAC[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine
SMILESCCC(C)C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C11H16ClFN2/c1-3-7(2)11(15-14)10-8(12)5-4-6-9(10)13/h4-7,11,15H,3,14H2,1-2H3
InChIKeyAVWGFBZVGHSNST-UHFFFAOYSA-N
MW230.71 g/mol
LogP3.03
Rot. Bonds4

About [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine

[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine (PubChem CID 105325664) has the molecular formula C11H16ClFN2 and a molecular weight of 230.71 g/mol. Its IUPAC name is [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine.

Molecular Properties

Compound Name[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine
PubChem CID105325664
Molecular FormulaC11H16ClFN2
Molecular Weight230.71 g/mol
Exact Mass230.10
IUPAC Name[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine
SMILESCCC(C)C(NN)c1c(F)cccc1Cl
InChIInChI=1S/C11H16ClFN2/c1-3-7(2)11(15-14)10-8(12)5-4-6-9(10)13/h4-7,11,15H,3,14H2,1-2H3
InChIKeyAVWGFBZVGHSNST-UHFFFAOYSA-N
XLogP3.03
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.71
LogP ≤ 53.03
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-(2-chloro-6-fluorophenyl)-2-methyl-N-propylbutan-1-amine
CID 105017578
[1-(2-chloro-6-fluorophenyl)-3-methylpentyl]hydrazine
CID 105298437
1-(2-chloro-6-fluorophenyl)-4-methoxy-N,2-dimethylbutan-1-amine
CID 105044732
1-(2-chloro-6-fluorophenyl)ethanamine
CID 53394777
[1-(2-chloro-6-fluorophenyl)-2-(2,6-difluorophenyl)ethyl]hydrazine
CID 105342808
3-(2-chloro-6-fluorophenyl)-2-methyl-N-propylbutan-1-amine
CID 114275307
3-(2-chloro-6-fluorophenyl)butan-2-amine
CID 126977015
(1S)-1-(2,6-dichlorophenyl)-2-methylbutan-1-amine;hydrochloride
CID 171217454
[1-(2-chloro-6-fluorophenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105295289
2-[1-(2-chloro-6-fluorophenyl)ethyl]propane-1,3-diamine
CID 83925233
1-chloro-3-fluoro-2-[(Z)-hept-4-en-2-yl]benzene
CID 83925287
1-(2-chloro-6-fluorophenyl)-N-ethylethane-1,2-diamine
CID 62066046

Frequently Asked Questions

What is the IUPAC name of [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine?
The IUPAC name of [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine (CID 105325664) is [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine.
What is the SMILES notation for [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine?
The canonical SMILES for [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine is CCC(C)C(NN)c1c(F)cccc1Cl.
What is the InChIKey of [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine?
The InChIKey is AVWGFBZVGHSNST-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClFN2/c1-3-7(2)11(15-14)10-8(12)5-4-6-9(10)13/h4-7,11,15H,3,14H2,1-2H3.
What are the key properties of [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine?
[1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine has a molecular weight of 230.71 g/mol, XLogP of 3.03, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-chloro-6-fluorophenyl)-2-methylbutyl]hydrazine is sourced from PubChem (CID 105325664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).