[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine

C15H23FN2 — CID 105232121

IUPAC[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)C2CCCCCC2)c1
InChIInChI=1S/C15H23FN2/c1-11-8-13(10-14(16)9-11)15(18-17)12-6-4-2-3-5-7-12/h8-10,12,15,18H,2-7,17H2,1H3
InChIKeyNVUCQVBMRDOSDD-UHFFFAOYSA-N
MW250.36 g/mol
LogP3.61
Rot. Bonds3

About [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine

[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine (PubChem CID 105232121) has the molecular formula C15H23FN2 and a molecular weight of 250.36 g/mol. Its IUPAC name is [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
PubChem CID105232121
Molecular FormulaC15H23FN2
Molecular Weight250.36 g/mol
Exact Mass250.18
IUPAC Name[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine
SMILESCc1cc(F)cc(C(NN)C2CCCCCC2)c1
InChIInChI=1S/C15H23FN2/c1-11-8-13(10-14(16)9-11)15(18-17)12-6-4-2-3-5-7-12/h8-10,12,15,18H,2-7,17H2,1H3
InChIKeyNVUCQVBMRDOSDD-UHFFFAOYSA-N
XLogP3.61
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.36
LogP ≤ 53.61
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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Frequently Asked Questions

What is the IUPAC name of [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The IUPAC name of [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine (CID 105232121) is [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine.
What is the SMILES notation for [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The canonical SMILES for [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine is Cc1cc(F)cc(C(NN)C2CCCCCC2)c1.
What is the InChIKey of [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
The InChIKey is NVUCQVBMRDOSDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23FN2/c1-11-8-13(10-14(16)9-11)15(18-17)12-6-4-2-3-5-7-12/h8-10,12,15,18H,2-7,17H2,1H3.
What are the key properties of [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine?
[cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine has a molecular weight of 250.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloheptyl-(3-fluoro-5-methylphenyl)methyl]hydrazine is sourced from PubChem (CID 105232121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).