6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine

C18H24N4O3 — CID 24747011

IUPAC6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
SMILESCOc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1OC
InChIInChI=1S/C18H24N4O3/c1-23-16-5-3-14(13-17(16)24-2)15-4-6-18(21-20-15)19-7-8-22-9-11-25-12-10-22/h3-6,13H,7-12H2,1-2H3,(H,19,21)
InChIKeyAFGSVFLIZWYSLV-UHFFFAOYSA-N
MW344.42 g/mol
LogP1.90
Rot. Bonds7

About 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine

6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine (PubChem CID 24747011) has the molecular formula C18H24N4O3 and a molecular weight of 344.42 g/mol. Its IUPAC name is 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
PubChem CID24747011
Molecular FormulaC18H24N4O3
Molecular Weight344.42 g/mol
Exact Mass344.18
IUPAC Name6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine
SMILESCOc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1OC
InChIInChI=1S/C18H24N4O3/c1-23-16-5-3-14(13-17(16)24-2)15-4-6-18(21-20-15)19-7-8-22-9-11-25-12-10-22/h3-6,13H,7-12H2,1-2H3,(H,19,21)
InChIKeyAFGSVFLIZWYSLV-UHFFFAOYSA-N
XLogP1.90
TPSA68.74 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.42
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The IUPAC name of 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine (CID 24747011) is 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine.
What is the SMILES notation for 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The canonical SMILES for 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine is COc1ccc(-c2ccc(NCCN3CCOCC3)nn2)cc1OC.
What is the InChIKey of 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
The InChIKey is AFGSVFLIZWYSLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O3/c1-23-16-5-3-14(13-17(16)24-2)15-4-6-18(21-20-15)19-7-8-22-9-11-25-12-10-22/h3-6,13H,7-12H2,1-2H3,(H,19,21).
What are the key properties of 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine?
6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine has a molecular weight of 344.42 g/mol, XLogP of 1.90, 7 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3,4-dimethoxyphenyl)-N-(2-morpholin-4-ylethyl)pyridazin-3-amine is sourced from PubChem (CID 24747011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).