[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine

C15H22ClFN2 — CID 105264361

IUPAC[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine
SMILESNNC(Cc1cccc(Cl)c1F)C1CCCCCC1
InChIInChI=1S/C15H22ClFN2/c16-13-9-5-8-12(15(13)17)10-14(19-18)11-6-3-1-2-4-7-11/h5,8-9,11,14,19H,1-4,6-7,10,18H2
InChIKeyPXMRWOPNRUYYCS-UHFFFAOYSA-N
MW284.81 g/mol
LogP3.82
Rot. Bonds4

About [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine

[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine (PubChem CID 105264361) has the molecular formula C15H22ClFN2 and a molecular weight of 284.81 g/mol. Its IUPAC name is [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine.

Molecular Properties

Compound Name[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine
PubChem CID105264361
Molecular FormulaC15H22ClFN2
Molecular Weight284.81 g/mol
Exact Mass284.15
IUPAC Name[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine
SMILESNNC(Cc1cccc(Cl)c1F)C1CCCCCC1
InChIInChI=1S/C15H22ClFN2/c16-13-9-5-8-12(15(13)17)10-14(19-18)11-6-3-1-2-4-7-11/h5,8-9,11,14,19H,1-4,6-7,10,18H2
InChIKeyPXMRWOPNRUYYCS-UHFFFAOYSA-N
XLogP3.82
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.81
LogP ≤ 53.82
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

[2-(3-chloro-2-fluorophenyl)-1-cyclopropylethyl]hydrazine
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[2-(2-bromo-3-fluorophenyl)-1-cyclooctylethyl]hydrazine
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[1-(3-chloro-2-fluorophenyl)-4-cyclohexylbutan-2-yl]hydrazine
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2-(3-chloro-2-fluorophenyl)-1-(4,4-difluorocyclohexyl)-N-methylethanamine
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1-(3-chloro-2-fluorophenyl)-3-cyclobutylpropan-2-amine
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Frequently Asked Questions

What is the IUPAC name of [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine?
The IUPAC name of [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine (CID 105264361) is [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine.
What is the SMILES notation for [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine?
The canonical SMILES for [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine is NNC(Cc1cccc(Cl)c1F)C1CCCCCC1.
What is the InChIKey of [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine?
The InChIKey is PXMRWOPNRUYYCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClFN2/c16-13-9-5-8-12(15(13)17)10-14(19-18)11-6-3-1-2-4-7-11/h5,8-9,11,14,19H,1-4,6-7,10,18H2.
What are the key properties of [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine?
[2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine has a molecular weight of 284.81 g/mol, XLogP of 3.82, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-chloro-2-fluorophenyl)-1-cycloheptylethyl]hydrazine is sourced from PubChem (CID 105264361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).