[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine

C14H22N4 — CID 65324881

IUPAC[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(CN2CCCC3CCCC32)cn1
InChIInChI=1S/C14H22N4/c15-17-14-7-6-11(9-16-14)10-18-8-2-4-12-3-1-5-13(12)18/h6-7,9,12-13H,1-5,8,10,15H2,(H,16,17)
InChIKeyILXZSKPQJJSUKL-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.13
Rot. Bonds3

About [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine

[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine (PubChem CID 65324881) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine
PubChem CID65324881
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine
SMILESNNc1ccc(CN2CCCC3CCCC32)cn1
InChIInChI=1S/C14H22N4/c15-17-14-7-6-11(9-16-14)10-18-8-2-4-12-3-1-5-13(12)18/h6-7,9,12-13H,1-5,8,10,15H2,(H,16,17)
InChIKeyILXZSKPQJJSUKL-UHFFFAOYSA-N
XLogP2.13
TPSA54.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 52.13
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 [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine?
The IUPAC name of [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine (CID 65324881) is [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine is NNc1ccc(CN2CCCC3CCCC32)cn1.
What is the InChIKey of [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine?
The InChIKey is ILXZSKPQJJSUKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c15-17-14-7-6-11(9-16-14)10-18-8-2-4-12-3-1-5-13(12)18/h6-7,9,12-13H,1-5,8,10,15H2,(H,16,17).
What are the key properties of [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine?
[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine has a molecular weight of 246.36 g/mol, XLogP of 2.13, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-ylmethyl)-2-pyridinyl]hydrazine is sourced from PubChem (CID 65324881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).