[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine

C15H22F2N2O — CID 105313509

IUPAC[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cccc(OC(F)F)c2)C1
InChIInChI=1S/C15H22F2N2O/c1-10-4-2-5-11(8-10)14(19-18)12-6-3-7-13(9-12)20-15(16)17/h3,6-7,9-11,14-15,19H,2,4-5,8,18H2,1H3
InChIKeyFVQYHJCJXNPCDU-UHFFFAOYSA-N
MW284.35 g/mol
LogP3.62
Rot. Bonds5

About [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine

[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine (PubChem CID 105313509) has the molecular formula C15H22F2N2O and a molecular weight of 284.35 g/mol. Its IUPAC name is [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine
PubChem CID105313509
Molecular FormulaC15H22F2N2O
Molecular Weight284.35 g/mol
Exact Mass284.17
IUPAC Name[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cccc(OC(F)F)c2)C1
InChIInChI=1S/C15H22F2N2O/c1-10-4-2-5-11(8-10)14(19-18)12-6-3-7-13(9-12)20-15(16)17/h3,6-7,9-11,14-15,19H,2,4-5,8,18H2,1H3
InChIKeyFVQYHJCJXNPCDU-UHFFFAOYSA-N
XLogP3.62
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
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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Frequently Asked Questions

What is the IUPAC name of [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine?
The IUPAC name of [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine (CID 105313509) is [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine is CC1CCCC(C(NN)c2cccc(OC(F)F)c2)C1.
What is the InChIKey of [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine?
The InChIKey is FVQYHJCJXNPCDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2O/c1-10-4-2-5-11(8-10)14(19-18)12-6-3-7-13(9-12)20-15(16)17/h3,6-7,9-11,14-15,19H,2,4-5,8,18H2,1H3.
What are the key properties of [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine?
[[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine has a molecular weight of 284.35 g/mol, XLogP of 3.62, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [[3-(difluoromethoxy)phenyl]-(3-methylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105313509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).