[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine

C14H23FN2O — CID 105252498

IUPAC[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine
SMILESCOc1cccc(F)c1C(CCC(C)(C)C)NN
InChIInChI=1S/C14H23FN2O/c1-14(2,3)9-8-11(17-16)13-10(15)6-5-7-12(13)18-4/h5-7,11,17H,8-9,16H2,1-4H3
InChIKeyQULGZNKCMMTQOC-UHFFFAOYSA-N
MW254.35 g/mol
LogP3.16
Rot. Bonds5

About [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine

[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine (PubChem CID 105252498) has the molecular formula C14H23FN2O and a molecular weight of 254.35 g/mol. Its IUPAC name is [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine
PubChem CID105252498
Molecular FormulaC14H23FN2O
Molecular Weight254.35 g/mol
Exact Mass254.18
IUPAC Name[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine
SMILESCOc1cccc(F)c1C(CCC(C)(C)C)NN
InChIInChI=1S/C14H23FN2O/c1-14(2,3)9-8-11(17-16)13-10(15)6-5-7-12(13)18-4/h5-7,11,17H,8-9,16H2,1-4H3
InChIKeyQULGZNKCMMTQOC-UHFFFAOYSA-N
XLogP3.16
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.35
LogP ≤ 53.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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-fluoro-6-methoxyphenyl)oct-7-enylhydrazine
CID 107012577
[2-(2-chloro-6-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252351
[1-(2-fluoro-6-methoxyphenyl)-3-(1-methylimidazol-2-yl)propyl]hydrazine
CID 105252516
[2-(3,4-dimethylphenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252484
3-[2-(2-fluoro-6-methoxyphenyl)-2-hydrazinylethyl]pyridin-4-amine
CID 105252589
[2-(4-chloro-3-fluorophenyl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 107895230
(1S)-1-(2-fluoro-6-methoxyphenyl)propane-1,3-diamine
CID 171230221
[2-(4-bromothiophen-2-yl)-1-(2-fluoro-6-methoxyphenyl)ethyl]hydrazine
CID 105252540
1-(2,6-dimethoxyphenyl)hexylhydrazine
CID 105294707
[1-(2,6-dimethoxyphenyl)-4-methoxybutyl]hydrazine
CID 105225087
1-(2,6-difluorophenyl)-4,4-dimethylpentan-1-ol
CID 65148322
1-(2-fluoro-6-methoxyphenyl)prop-2-ynylhydrazine
CID 105252451

Frequently Asked Questions

What is the IUPAC name of [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The IUPAC name of [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine (CID 105252498) is [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine.
What is the SMILES notation for [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The canonical SMILES for [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine is COc1cccc(F)c1C(CCC(C)(C)C)NN.
What is the InChIKey of [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The InChIKey is QULGZNKCMMTQOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23FN2O/c1-14(2,3)9-8-11(17-16)13-10(15)6-5-7-12(13)18-4/h5-7,11,17H,8-9,16H2,1-4H3.
What are the key properties of [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine?
[1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine has a molecular weight of 254.35 g/mol, XLogP of 3.16, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-fluoro-6-methoxyphenyl)-4,4-dimethylpentyl]hydrazine is sourced from PubChem (CID 105252498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).