6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine

C8H8ClN3O — CID 122508037

IUPAC6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine
SMILESNc1nnc(Cl)cc1C1=CCCO1
InChIInChI=1S/C8H8ClN3O/c9-7-4-5(8(10)12-11-7)6-2-1-3-13-6/h2,4H,1,3H2,(H2,10,12)
InChIKeyDPCBKPZJWHJCGB-UHFFFAOYSA-N
MW197.62 g/mol
LogP1.47
Rot. Bonds1

About 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine

6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine (PubChem CID 122508037) has the molecular formula C8H8ClN3O and a molecular weight of 197.62 g/mol. Its IUPAC name is 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine.

Molecular Properties

Compound Name6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine
PubChem CID122508037
Molecular FormulaC8H8ClN3O
Molecular Weight197.62 g/mol
Exact Mass197.04
IUPAC Name6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine
SMILESNc1nnc(Cl)cc1C1=CCCO1
InChIInChI=1S/C8H8ClN3O/c9-7-4-5(8(10)12-11-7)6-2-1-3-13-6/h2,4H,1,3H2,(H2,10,12)
InChIKeyDPCBKPZJWHJCGB-UHFFFAOYSA-N
XLogP1.47
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.62
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine?
The IUPAC name of 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine (CID 122508037) is 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine.
What is the SMILES notation for 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine?
The canonical SMILES for 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine is Nc1nnc(Cl)cc1C1=CCCO1.
What is the InChIKey of 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine?
The InChIKey is DPCBKPZJWHJCGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3O/c9-7-4-5(8(10)12-11-7)6-2-1-3-13-6/h2,4H,1,3H2,(H2,10,12).
What are the key properties of 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine?
6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine has a molecular weight of 197.62 g/mol, XLogP of 1.47, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-4-(2,3-dihydrofuran-5-yl)pyridazin-3-amine is sourced from PubChem (CID 122508037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).