[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine

C17H26ClFN2 — CID 105232745

IUPAC[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine
SMILESCC(C)(C)C1CCC(C(NN)c2ccc(Cl)cc2F)CC1
InChIInChI=1S/C17H26ClFN2/c1-17(2,3)12-6-4-11(5-7-12)16(21-20)14-9-8-13(18)10-15(14)19/h8-12,16,21H,4-7,20H2,1-3H3
InChIKeyUWKLXDMAZNYRHF-UHFFFAOYSA-N
MW312.86 g/mol
LogP4.84
Rot. Bonds3

About [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine

[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine (PubChem CID 105232745) has the molecular formula C17H26ClFN2 and a molecular weight of 312.86 g/mol. Its IUPAC name is [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine
PubChem CID105232745
Molecular FormulaC17H26ClFN2
Molecular Weight312.86 g/mol
Exact Mass312.18
IUPAC Name[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine
SMILESCC(C)(C)C1CCC(C(NN)c2ccc(Cl)cc2F)CC1
InChIInChI=1S/C17H26ClFN2/c1-17(2,3)12-6-4-11(5-7-12)16(21-20)14-9-8-13(18)10-15(14)19/h8-12,16,21H,4-7,20H2,1-3H3
InChIKeyUWKLXDMAZNYRHF-UHFFFAOYSA-N
XLogP4.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.86
LogP ≤ 54.84
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

[(4-tert-butylcyclohexyl)-(2,4-difluorophenyl)methyl]hydrazine
CID 105232729
[(4-chloro-2-fluorophenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232537
[(4-chloro-2-fluorophenyl)-cycloheptylmethyl]hydrazine
CID 105217855
[(4-tert-butylcyclohexyl)-(3,4-difluorophenyl)methyl]hydrazine
CID 105232707
[(2,4-difluorophenyl)-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
CID 105303248
[(4-tert-butylcyclohexyl)-(2,3-dichlorophenyl)methyl]hydrazine
CID 105232732
[(2,5-dichlorophenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
CID 105232515
[cyclopropyl-[2-fluoro-5-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105250205
1-(4-tert-butylcyclohexyl)-1-(2-fluorophenyl)-N-methylmethanamine
CID 65400352
[(2,5-difluorophenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105210581
[cyclohexyl-(2,4-dichlorophenyl)methyl]hydrazine
CID 105282000
[(2-fluoro-5-methylphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105210507

Frequently Asked Questions

What is the IUPAC name of [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The IUPAC name of [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine (CID 105232745) is [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine.
What is the SMILES notation for [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The canonical SMILES for [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine is CC(C)(C)C1CCC(C(NN)c2ccc(Cl)cc2F)CC1.
What is the InChIKey of [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
The InChIKey is UWKLXDMAZNYRHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26ClFN2/c1-17(2,3)12-6-4-11(5-7-12)16(21-20)14-9-8-13(18)10-15(14)19/h8-12,16,21H,4-7,20H2,1-3H3.
What are the key properties of [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine?
[(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine has a molecular weight of 312.86 g/mol, XLogP of 4.84, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-tert-butylcyclohexyl)-(4-chloro-2-fluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105232745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).