2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide

C12H20N4O3 — CID 103219006

IUPAC2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
SMILESCCNc1cnn(CC(=O)NC(C)COC)c(=O)c1
InChIInChI=1S/C12H20N4O3/c1-4-13-10-5-12(18)16(14-6-10)7-11(17)15-9(2)8-19-3/h5-6,9,13H,4,7-8H2,1-3H3,(H,15,17)
InChIKeyBTPGXAZQCVMSDT-UHFFFAOYSA-N
MW268.32 g/mol
LogP-0.17
Rot. Bonds7

About 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide

2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide (PubChem CID 103219006) has the molecular formula C12H20N4O3 and a molecular weight of 268.32 g/mol. Its IUPAC name is 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide.

Molecular Properties

Compound Name2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
PubChem CID103219006
Molecular FormulaC12H20N4O3
Molecular Weight268.32 g/mol
Exact Mass268.15
IUPAC Name2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide
SMILESCCNc1cnn(CC(=O)NC(C)COC)c(=O)c1
InChIInChI=1S/C12H20N4O3/c1-4-13-10-5-12(18)16(14-6-10)7-11(17)15-9(2)8-19-3/h5-6,9,13H,4,7-8H2,1-3H3,(H,15,17)
InChIKeyBTPGXAZQCVMSDT-UHFFFAOYSA-N
XLogP-0.17
TPSA85.25 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 5-0.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The IUPAC name of 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide (CID 103219006) is 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide.
What is the SMILES notation for 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The canonical SMILES for 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide is CCNc1cnn(CC(=O)NC(C)COC)c(=O)c1.
What is the InChIKey of 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
The InChIKey is BTPGXAZQCVMSDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4O3/c1-4-13-10-5-12(18)16(14-6-10)7-11(17)15-9(2)8-19-3/h5-6,9,13H,4,7-8H2,1-3H3,(H,15,17).
What are the key properties of 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide?
2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide has a molecular weight of 268.32 g/mol, XLogP of -0.17, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(ethylamino)-6-oxopyridazin-1-yl]-N-(1-methoxypropan-2-yl)acetamide is sourced from PubChem (CID 103219006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).