[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine

C17H26N2O — CID 105266649

IUPAC[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccccc1C(NN)C1CC2CCC1C2
InChIInChI=1S/C17H26N2O/c1-2-9-20-16-6-4-3-5-14(16)17(19-18)15-11-12-7-8-13(15)10-12/h3-6,12-13,15,17,19H,2,7-11,18H2,1H3
InChIKeyRVQDUJFHMGWQCI-UHFFFAOYSA-N
MW274.41 g/mol
LogP3.42
Rot. Bonds6

About [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine

[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine (PubChem CID 105266649) has the molecular formula C17H26N2O and a molecular weight of 274.41 g/mol. Its IUPAC name is [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine.

Molecular Properties

Compound Name[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine
PubChem CID105266649
Molecular FormulaC17H26N2O
Molecular Weight274.41 g/mol
Exact Mass274.20
IUPAC Name[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine
SMILESCCCOc1ccccc1C(NN)C1CC2CCC1C2
InChIInChI=1S/C17H26N2O/c1-2-9-20-16-6-4-3-5-14(16)17(19-18)15-11-12-7-8-13(15)10-12/h3-6,12-13,15,17,19H,2,7-11,18H2,1H3
InChIKeyRVQDUJFHMGWQCI-UHFFFAOYSA-N
XLogP3.42
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.41
LogP ≤ 53.42
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-ethylcyclohexyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105232856
[(4,4-difluorocyclohexyl)-(2-propoxyphenyl)methyl]hydrazine
CID 105334414
2-(2-bicyclo[2.2.1]heptanyl)-N-methyl-1-(2-propoxyphenyl)ethanamine
CID 105035765
[2-bicyclo[2.2.1]heptanyl-(2,6-dimethoxyphenyl)methyl]hydrazine
CID 105266791
N-[3-bicyclo[3.1.0]hexanyl-(2-propoxyphenyl)methyl]ethanamine
CID 105035798
[(2-ethoxyphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105210206
N-(2-propoxyphenyl)bicyclo[2.2.1]heptan-2-amine
CID 63426599
N-[6-bicyclo[3.1.0]hexanyl-(2-propoxyphenyl)methyl]ethanamine
CID 105035932
N-(2-bicyclo[2.2.1]heptanyl)-3-propoxypyridin-2-amine
CID 113370946
[(2,2-dimethylcyclopropyl)-[2-(2-methoxyethoxy)phenyl]methyl]hydrazine
CID 107005838
[2-(oxolan-2-yl)-1-(2-propoxyphenyl)ethyl]hydrazine
CID 105198546
N-[oxan-4-yl-(2-propoxyphenyl)methyl]propan-1-amine
CID 104660281

Frequently Asked Questions

What is the IUPAC name of [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine?
The IUPAC name of [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine (CID 105266649) is [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine.
What is the SMILES notation for [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine?
The canonical SMILES for [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine is CCCOc1ccccc1C(NN)C1CC2CCC1C2.
What is the InChIKey of [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine?
The InChIKey is RVQDUJFHMGWQCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O/c1-2-9-20-16-6-4-3-5-14(16)17(19-18)15-11-12-7-8-13(15)10-12/h3-6,12-13,15,17,19H,2,7-11,18H2,1H3.
What are the key properties of [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine?
[2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine has a molecular weight of 274.41 g/mol, XLogP of 3.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-bicyclo[2.2.1]heptanyl-(2-propoxyphenyl)methyl]hydrazine is sourced from PubChem (CID 105266649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).