6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine

C10H10ClN3O — CID 43401135

IUPAC6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine
SMILESCC(Nc1ccc(Cl)nn1)c1ccco1
InChIInChI=1S/C10H10ClN3O/c1-7(8-3-2-6-15-8)12-10-5-4-9(11)13-14-10/h2-7H,1H3,(H,12,14)
InChIKeyDXYNKUXPQVCBMQ-UHFFFAOYSA-N
MW223.66 g/mol
LogP2.90
Rot. Bonds3

About 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine

6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine (PubChem CID 43401135) has the molecular formula C10H10ClN3O and a molecular weight of 223.66 g/mol. Its IUPAC name is 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine
PubChem CID43401135
Molecular FormulaC10H10ClN3O
Molecular Weight223.66 g/mol
Exact Mass223.05
IUPAC Name6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine
SMILESCC(Nc1ccc(Cl)nn1)c1ccco1
InChIInChI=1S/C10H10ClN3O/c1-7(8-3-2-6-15-8)12-10-5-4-9(11)13-14-10/h2-7H,1H3,(H,12,14)
InChIKeyDXYNKUXPQVCBMQ-UHFFFAOYSA-N
XLogP2.90
TPSA50.95 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.66
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine?
The IUPAC name of 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine (CID 43401135) is 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine.
What is the SMILES notation for 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine?
The canonical SMILES for 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine is CC(Nc1ccc(Cl)nn1)c1ccco1.
What is the InChIKey of 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine?
The InChIKey is DXYNKUXPQVCBMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClN3O/c1-7(8-3-2-6-15-8)12-10-5-4-9(11)13-14-10/h2-7H,1H3,(H,12,14).
What are the key properties of 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine?
6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine has a molecular weight of 223.66 g/mol, XLogP of 2.90, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-[1-(furan-2-yl)ethyl]pyridazin-3-amine is sourced from PubChem (CID 43401135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).