[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine

C17H26N2O2 — CID 105323624

IUPAC[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine
SMILESCOc1cc(OC)cc(C(CC2CC3CCC2C3)NN)c1
InChIInChI=1S/C17H26N2O2/c1-20-15-7-14(8-16(10-15)21-2)17(19-18)9-13-6-11-3-4-12(13)5-11/h7-8,10-13,17,19H,3-6,9,18H2,1-2H3
InChIKeyGBDFEFNBLNOQLT-UHFFFAOYSA-N
MW290.41 g/mol
LogP3.03
Rot. Bonds6

About [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine

[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine (PubChem CID 105323624) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine
PubChem CID105323624
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC Name[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine
SMILESCOc1cc(OC)cc(C(CC2CC3CCC2C3)NN)c1
InChIInChI=1S/C17H26N2O2/c1-20-15-7-14(8-16(10-15)21-2)17(19-18)9-13-6-11-3-4-12(13)5-11/h7-8,10-13,17,19H,3-6,9,18H2,1-2H3
InChIKeyGBDFEFNBLNOQLT-UHFFFAOYSA-N
XLogP3.03
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine?
The IUPAC name of [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine (CID 105323624) is [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine.
What is the SMILES notation for [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine?
The canonical SMILES for [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine is COc1cc(OC)cc(C(CC2CC3CCC2C3)NN)c1.
What is the InChIKey of [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine?
The InChIKey is GBDFEFNBLNOQLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c1-20-15-7-14(8-16(10-15)21-2)17(19-18)9-13-6-11-3-4-12(13)5-11/h7-8,10-13,17,19H,3-6,9,18H2,1-2H3.
What are the key properties of [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine?
[2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine has a molecular weight of 290.41 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bicyclo[2.2.1]heptanyl)-1-(3,5-dimethoxyphenyl)ethyl]hydrazine is sourced from PubChem (CID 105323624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).