3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide

C11H18N4O2 — CID 103219214

IUPAC3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide
SMILESCCNc1cnn(CCC(=O)N(C)C)c(=O)c1
InChIInChI=1S/C11H18N4O2/c1-4-12-9-7-11(17)15(13-8-9)6-5-10(16)14(2)3/h7-8,12H,4-6H2,1-3H3
InChIKeyGTSQGCXRVGTEIK-UHFFFAOYSA-N
MW238.29 g/mol
LogP0.15
Rot. Bonds5

About 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide

3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide (PubChem CID 103219214) has the molecular formula C11H18N4O2 and a molecular weight of 238.29 g/mol. Its IUPAC name is 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide
PubChem CID103219214
Molecular FormulaC11H18N4O2
Molecular Weight238.29 g/mol
Exact Mass238.14
IUPAC Name3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide
SMILESCCNc1cnn(CCC(=O)N(C)C)c(=O)c1
InChIInChI=1S/C11H18N4O2/c1-4-12-9-7-11(17)15(13-8-9)6-5-10(16)14(2)3/h7-8,12H,4-6H2,1-3H3
InChIKeyGTSQGCXRVGTEIK-UHFFFAOYSA-N
XLogP0.15
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide?
The IUPAC name of 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide (CID 103219214) is 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide.
What is the SMILES notation for 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide?
The canonical SMILES for 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide is CCNc1cnn(CCC(=O)N(C)C)c(=O)c1.
What is the InChIKey of 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide?
The InChIKey is GTSQGCXRVGTEIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O2/c1-4-12-9-7-11(17)15(13-8-9)6-5-10(16)14(2)3/h7-8,12H,4-6H2,1-3H3.
What are the key properties of 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide?
3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide has a molecular weight of 238.29 g/mol, XLogP of 0.15, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(ethylamino)-6-oxopyridazin-1-yl]-N,N-dimethylpropanamide is sourced from PubChem (CID 103219214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).