[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine

C11H16ClFN2O — CID 103053532

IUPAC[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine
SMILESCOCCC(Cc1cc(Cl)ccc1F)NN
InChIInChI=1S/C11H16ClFN2O/c1-16-5-4-10(15-14)7-8-6-9(12)2-3-11(8)13/h2-3,6,10,15H,4-5,7,14H2,1H3
InChIKeyMJNJFJIXEUUOOI-UHFFFAOYSA-N
MW246.71 g/mol
LogP1.89
Rot. Bonds6

About [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine

[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine (PubChem CID 103053532) has the molecular formula C11H16ClFN2O and a molecular weight of 246.71 g/mol. Its IUPAC name is [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine.

Molecular Properties

Compound Name[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine
PubChem CID103053532
Molecular FormulaC11H16ClFN2O
Molecular Weight246.71 g/mol
Exact Mass246.09
IUPAC Name[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine
SMILESCOCCC(Cc1cc(Cl)ccc1F)NN
InChIInChI=1S/C11H16ClFN2O/c1-16-5-4-10(15-14)7-8-6-9(12)2-3-11(8)13/h2-3,6,10,15H,4-5,7,14H2,1H3
InChIKeyMJNJFJIXEUUOOI-UHFFFAOYSA-N
XLogP1.89
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.71
LogP ≤ 51.89
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-(5-chloro-2-fluorophenyl)-5-methoxypentan-2-yl]hydrazine
CID 103053586
[1-(4-chloro-2-fluorophenyl)-4-(2-methoxyethoxy)butan-2-yl]hydrazine
CID 102929991
1-(5-chloro-2-fluorophenyl)octan-2-ylhydrazine
CID 103053822
1-(5-chloro-2-fluorophenyl)decan-2-ylhydrazine
CID 103053761
[1-(3,4-difluorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206458
[1-(2,4-dichlorophenyl)-5-methoxypentan-2-yl]hydrazine
CID 105200199
[1-(2-chlorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206395
[1-(2-chloro-4-methylphenyl)-4-methoxybutan-2-yl]hydrazine
CID 106868463
[1-(5-chloro-2-fluorophenyl)-3-[(2-methylpropan-2-yl)oxy]propan-2-yl]hydrazine
CID 103053888
[1-(4-chloro-2-fluorophenyl)-4-propoxybutan-2-yl]hydrazine
CID 105342708
[1-(4-bromo-2-chlorophenyl)-4-methoxybutan-2-yl]hydrazine
CID 105206418
[1-(5-chloro-2-fluorophenyl)-3-(3-methoxyphenyl)propan-2-yl]hydrazine
CID 103053528

Frequently Asked Questions

What is the IUPAC name of [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine?
The IUPAC name of [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine (CID 103053532) is [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine.
What is the SMILES notation for [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine?
The canonical SMILES for [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine is COCCC(Cc1cc(Cl)ccc1F)NN.
What is the InChIKey of [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine?
The InChIKey is MJNJFJIXEUUOOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16ClFN2O/c1-16-5-4-10(15-14)7-8-6-9(12)2-3-11(8)13/h2-3,6,10,15H,4-5,7,14H2,1H3.
What are the key properties of [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine?
[1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine has a molecular weight of 246.71 g/mol, XLogP of 1.89, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(5-chloro-2-fluorophenyl)-4-methoxybutan-2-yl]hydrazine is sourced from PubChem (CID 103053532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).