[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine

C17H27FN2O — CID 105277963

IUPAC[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCOC1(C(NN)c2cc(F)ccc2C)CCC(C)(C)CC1
InChIInChI=1S/C17H27FN2O/c1-12-5-6-13(18)11-14(12)15(20-19)17(21-4)9-7-16(2,3)8-10-17/h5-6,11,15,20H,7-10,19H2,1-4H3
InChIKeyRXXIPOQNBQZMEI-UHFFFAOYSA-N
MW294.41 g/mol
LogP3.62
Rot. Bonds4

About [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine

[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine (PubChem CID 105277963) has the molecular formula C17H27FN2O and a molecular weight of 294.41 g/mol. Its IUPAC name is [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
PubChem CID105277963
Molecular FormulaC17H27FN2O
Molecular Weight294.41 g/mol
Exact Mass294.21
IUPAC Name[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
SMILESCOC1(C(NN)c2cc(F)ccc2C)CCC(C)(C)CC1
InChIInChI=1S/C17H27FN2O/c1-12-5-6-13(18)11-14(12)15(20-19)17(21-4)9-7-16(2,3)8-10-17/h5-6,11,15,20H,7-10,19H2,1-4H3
InChIKeyRXXIPOQNBQZMEI-UHFFFAOYSA-N
XLogP3.62
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.41
LogP ≤ 53.62
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

[(5-fluoro-2-methylphenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105275942
(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methanol
CID 116755728
[(2-chloro-5-fluorophenyl)-(1-methoxycycloheptyl)methyl]hydrazine
CID 105397994
[(3-chloro-4-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 107562491
[(5-fluoro-2-methoxyphenyl)-(1-methoxycyclohexyl)methyl]hydrazine
CID 105276084
(5-fluoro-2-methylphenyl)-(1-methoxycyclobutyl)methanamine
CID 116713879
(1-ethoxy-4,4-dimethylcyclohexyl)-(5-fluoro-2-methylphenyl)methanamine
CID 116768560
[(5-fluoro-2-methoxyphenyl)-(1-methylcyclopropyl)methyl]hydrazine
CID 105253466
[(2,6-difluoro-3-methylphenyl)-(1-methoxycyclobutyl)methyl]hydrazine
CID 105270270
[(3-ethylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine
CID 105277954
[(4-chloro-2-fluorophenyl)-(1-methoxycyclopentyl)methyl]hydrazine
CID 105268763
[(1-ethoxycycloheptyl)-(4-fluoro-2-methylphenyl)methyl]hydrazine
CID 105278412

Frequently Asked Questions

What is the IUPAC name of [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine (CID 105277963) is [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine is COC1(C(NN)c2cc(F)ccc2C)CCC(C)(C)CC1.
What is the InChIKey of [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine?
The InChIKey is RXXIPOQNBQZMEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27FN2O/c1-12-5-6-13(18)11-14(12)15(20-19)17(21-4)9-7-16(2,3)8-10-17/h5-6,11,15,20H,7-10,19H2,1-4H3.
What are the key properties of [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine?
[(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine has a molecular weight of 294.41 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(5-fluoro-2-methylphenyl)-(1-methoxy-4,4-dimethylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105277963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).