1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide

C9H12N4O3 — CID 166850861

IUPAC1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide
SMILESCCNC(=O)Cn1nc(C(N)=O)ccc1=O
InChIInChI=1S/C9H12N4O3/c1-2-11-7(14)5-13-8(15)4-3-6(12-13)9(10)16/h3-4H,2,5H2,1H3,(H2,10,16)(H,11,14)
InChIKeyGWPOKLQQTLTVQM-UHFFFAOYSA-N
MW224.22 g/mol
LogP-1.52
Rot. Bonds4

About 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide

1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide (PubChem CID 166850861) has the molecular formula C9H12N4O3 and a molecular weight of 224.22 g/mol. Its IUPAC name is 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide.

Molecular Properties

Compound Name1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide
PubChem CID166850861
Molecular FormulaC9H12N4O3
Molecular Weight224.22 g/mol
Exact Mass224.09
IUPAC Name1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide
SMILESCCNC(=O)Cn1nc(C(N)=O)ccc1=O
InChIInChI=1S/C9H12N4O3/c1-2-11-7(14)5-13-8(15)4-3-6(12-13)9(10)16/h3-4H,2,5H2,1H3,(H2,10,16)(H,11,14)
InChIKeyGWPOKLQQTLTVQM-UHFFFAOYSA-N
XLogP-1.52
TPSA107.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-1.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide?
The IUPAC name of 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide (CID 166850861) is 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide.
What is the SMILES notation for 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide?
The canonical SMILES for 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide is CCNC(=O)Cn1nc(C(N)=O)ccc1=O.
What is the InChIKey of 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide?
The InChIKey is GWPOKLQQTLTVQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O3/c1-2-11-7(14)5-13-8(15)4-3-6(12-13)9(10)16/h3-4H,2,5H2,1H3,(H2,10,16)(H,11,14).
What are the key properties of 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide?
1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide has a molecular weight of 224.22 g/mol, XLogP of -1.52, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(ethylamino)-2-oxoethyl]-6-oxopyridazine-3-carboxamide is sourced from PubChem (CID 166850861), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).