[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine

C14H21N3 — CID 105196324

IUPAC[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine
SMILESNNC(CC1CC2CCC1C2)c1cccnc1
InChIInChI=1S/C14H21N3/c15-17-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h1-2,5,9-11,13-14,17H,3-4,6-8,15H2
InChIKeyNIRUXYRQKWVGDP-UHFFFAOYSA-N
MW231.34 g/mol
LogP2.41
Rot. Bonds4

About [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine

[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine (PubChem CID 105196324) has the molecular formula C14H21N3 and a molecular weight of 231.34 g/mol. Its IUPAC name is [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine.

Molecular Properties

Compound Name[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine
PubChem CID105196324
Molecular FormulaC14H21N3
Molecular Weight231.34 g/mol
Exact Mass231.17
IUPAC Name[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine
SMILESNNC(CC1CC2CCC1C2)c1cccnc1
InChIInChI=1S/C14H21N3/c15-17-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h1-2,5,9-11,13-14,17H,3-4,6-8,15H2
InChIKeyNIRUXYRQKWVGDP-UHFFFAOYSA-N
XLogP2.41
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 52.41
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 [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine?
The IUPAC name of [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine (CID 105196324) is [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine.
What is the SMILES notation for [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine?
The canonical SMILES for [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine is NNC(CC1CC2CCC1C2)c1cccnc1.
What is the InChIKey of [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine?
The InChIKey is NIRUXYRQKWVGDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3/c15-17-14(12-2-1-5-16-9-12)8-13-7-10-3-4-11(13)6-10/h1-2,5,9-11,13-14,17H,3-4,6-8,15H2.
What are the key properties of [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine?
[2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine has a molecular weight of 231.34 g/mol, XLogP of 2.41, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-bicyclo[2.2.1]heptanyl)-1-pyridin-3-ylethyl]hydrazine is sourced from PubChem (CID 105196324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).