[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine

C17H28N2O — CID 105232508

IUPAC[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)C2CCC(C(C)C)CC2)c1
InChIInChI=1S/C17H28N2O/c1-12(2)13-7-9-14(10-8-13)17(19-18)15-5-4-6-16(11-15)20-3/h4-6,11-14,17,19H,7-10,18H2,1-3H3
InChIKeyXCHAPVNWSLINPE-UHFFFAOYSA-N
MW276.42 g/mol
LogP3.66
Rot. Bonds5

About [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine

[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine (PubChem CID 105232508) has the molecular formula C17H28N2O and a molecular weight of 276.42 g/mol. Its IUPAC name is [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
PubChem CID105232508
Molecular FormulaC17H28N2O
Molecular Weight276.42 g/mol
Exact Mass276.22
IUPAC Name[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine
SMILESCOc1cccc(C(NN)C2CCC(C(C)C)CC2)c1
InChIInChI=1S/C17H28N2O/c1-12(2)13-7-9-14(10-8-13)17(19-18)15-5-4-6-16(11-15)20-3/h4-6,11-14,17,19H,7-10,18H2,1-3H3
InChIKeyXCHAPVNWSLINPE-UHFFFAOYSA-N
XLogP3.66
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.42
LogP ≤ 53.66
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

[(3-methoxyphenyl)-(4-methylcyclohexyl)methyl]hydrazine
CID 105191732
[cyclohexyl-(3-methoxyphenyl)methyl]hydrazine
CID 105191678
[(3-methoxyphenyl)-(4-propylcyclohexyl)methyl]hydrazine
CID 105232266
[2-cyclopropyl-1-(3-methoxyphenyl)propyl]hydrazine
CID 105283576
N-[cyclopropyl-(3-methoxyphenyl)methyl]ethanamine
CID 60820098
[cyclopropyl-(4-methoxyphenyl)methyl]hydrazine
CID 53403096
(1R)-N-[cyclopropyl(phenyl)methyl]-1-(3-methoxyphenyl)ethanamine
CID 81381917
[2-cyclopropyl-1-(3-methoxyphenyl)ethyl]hydrazine
CID 105191557
[cyclopentyl-(3-ethoxyphenyl)methyl]hydrazine
CID 105191906
2-cyclopropyl-1-(3-methoxyphenyl)propan-1-amine
CID 115785759
[cyclopropyl-(3-methoxy-4-methylphenyl)methyl]hydrazine
CID 105314485
N-[cyclopentyl-(3-methoxyphenyl)methyl]ethanamine
CID 60797775

Frequently Asked Questions

What is the IUPAC name of [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine?
The IUPAC name of [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine (CID 105232508) is [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine is COc1cccc(C(NN)C2CCC(C(C)C)CC2)c1.
What is the InChIKey of [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine?
The InChIKey is XCHAPVNWSLINPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O/c1-12(2)13-7-9-14(10-8-13)17(19-18)15-5-4-6-16(11-15)20-3/h4-6,11-14,17,19H,7-10,18H2,1-3H3.
What are the key properties of [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine?
[(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine has a molecular weight of 276.42 g/mol, XLogP of 3.66, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-methoxyphenyl)-(4-propan-2-ylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105232508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).