6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine

C9H8ClN3O — CID 19164210

IUPAC6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine
SMILESClc1ccc(NCc2ccco2)nn1
InChIInChI=1S/C9H8ClN3O/c10-8-3-4-9(13-12-8)11-6-7-2-1-5-14-7/h1-5H,6H2,(H,11,13)
InChIKeyNTZYTEKCZDNYLZ-UHFFFAOYSA-N
MW209.64 g/mol
LogP2.34
Rot. Bonds3

About 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine

6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine (PubChem CID 19164210) has the molecular formula C9H8ClN3O and a molecular weight of 209.64 g/mol. Its IUPAC name is 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine
PubChem CID19164210
Molecular FormulaC9H8ClN3O
Molecular Weight209.64 g/mol
Exact Mass209.04
IUPAC Name6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine
SMILESClc1ccc(NCc2ccco2)nn1
InChIInChI=1S/C9H8ClN3O/c10-8-3-4-9(13-12-8)11-6-7-2-1-5-14-7/h1-5H,6H2,(H,11,13)
InChIKeyNTZYTEKCZDNYLZ-UHFFFAOYSA-N
XLogP2.34
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.64
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine?
The IUPAC name of 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine (CID 19164210) is 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine is Clc1ccc(NCc2ccco2)nn1.
What is the InChIKey of 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine?
The InChIKey is NTZYTEKCZDNYLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8ClN3O/c10-8-3-4-9(13-12-8)11-6-7-2-1-5-14-7/h1-5H,6H2,(H,11,13).
What are the key properties of 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine?
6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine has a molecular weight of 209.64 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(furan-2-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 19164210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).