2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide

C19H20N4O3 — CID 45226784

IUPAC2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide
SMILESCN(C)c1cnn(CC(=O)NC(c2ccccc2)c2ccco2)c(=O)c1
InChIInChI=1S/C19H20N4O3/c1-22(2)15-11-18(25)23(20-12-15)13-17(24)21-19(16-9-6-10-26-16)14-7-4-3-5-8-14/h3-12,19H,13H2,1-2H3,(H,21,24)
InChIKeyQPGABEASAFAVCR-UHFFFAOYSA-N
MW352.39 g/mol
LogP1.81
Rot. Bonds6

About 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide

2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide (PubChem CID 45226784) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide
PubChem CID45226784
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide
SMILESCN(C)c1cnn(CC(=O)NC(c2ccccc2)c2ccco2)c(=O)c1
InChIInChI=1S/C19H20N4O3/c1-22(2)15-11-18(25)23(20-12-15)13-17(24)21-19(16-9-6-10-26-16)14-7-4-3-5-8-14/h3-12,19H,13H2,1-2H3,(H,21,24)
InChIKeyQPGABEASAFAVCR-UHFFFAOYSA-N
XLogP1.81
TPSA80.37 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide?
The IUPAC name of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide (CID 45226784) is 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide.
What is the SMILES notation for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide?
The canonical SMILES for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide is CN(C)c1cnn(CC(=O)NC(c2ccccc2)c2ccco2)c(=O)c1.
What is the InChIKey of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide?
The InChIKey is QPGABEASAFAVCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-22(2)15-11-18(25)23(20-12-15)13-17(24)21-19(16-9-6-10-26-16)14-7-4-3-5-8-14/h3-12,19H,13H2,1-2H3,(H,21,24).
What are the key properties of 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide?
2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide has a molecular weight of 352.39 g/mol, XLogP of 1.81, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylamino)-6-oxopyridazin-1-yl]-N-[furan-2-yl(phenyl)methyl]acetamide is sourced from PubChem (CID 45226784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).