[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine

C11H12ClN3O — CID 105331834

IUPAC[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccoc1)c1ccncc1Cl
InChIInChI=1S/C11H12ClN3O/c12-10-6-14-3-1-9(10)11(15-13)5-8-2-4-16-7-8/h1-4,6-7,11,15H,5,13H2
InChIKeyCWHBUWRJINIUEU-UHFFFAOYSA-N
MW237.69 g/mol
LogP2.08
Rot. Bonds4

About [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine

[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine (PubChem CID 105331834) has the molecular formula C11H12ClN3O and a molecular weight of 237.69 g/mol. Its IUPAC name is [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine
PubChem CID105331834
Molecular FormulaC11H12ClN3O
Molecular Weight237.69 g/mol
Exact Mass237.07
IUPAC Name[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine
SMILESNNC(Cc1ccoc1)c1ccncc1Cl
InChIInChI=1S/C11H12ClN3O/c12-10-6-14-3-1-9(10)11(15-13)5-8-2-4-16-7-8/h1-4,6-7,11,15H,5,13H2
InChIKeyCWHBUWRJINIUEU-UHFFFAOYSA-N
XLogP2.08
TPSA64.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.69
LogP ≤ 52.08
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 [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine?
The IUPAC name of [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine (CID 105331834) is [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine?
The canonical SMILES for [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine is NNC(Cc1ccoc1)c1ccncc1Cl.
What is the InChIKey of [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine?
The InChIKey is CWHBUWRJINIUEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN3O/c12-10-6-14-3-1-9(10)11(15-13)5-8-2-4-16-7-8/h1-4,6-7,11,15H,5,13H2.
What are the key properties of [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine?
[1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine has a molecular weight of 237.69 g/mol, XLogP of 2.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-chloro-4-pyridinyl)-2-(furan-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105331834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).