N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide

C10H13N3O3 — CID 139772198

IUPACN-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide
SMILESCNC(=O)CCC(=O)Cn1ncccc1=O
InChIInChI=1S/C10H13N3O3/c1-11-9(15)5-4-8(14)7-13-10(16)3-2-6-12-13/h2-3,6H,4-5,7H2,1H3,(H,11,15)
InChIKeyNAHIDDYZJONLQO-UHFFFAOYSA-N
MW223.23 g/mol
LogP-0.66
Rot. Bonds5

About N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide

N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide (PubChem CID 139772198) has the molecular formula C10H13N3O3 and a molecular weight of 223.23 g/mol. Its IUPAC name is N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide.

Molecular Properties

Compound NameN-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide
PubChem CID139772198
Molecular FormulaC10H13N3O3
Molecular Weight223.23 g/mol
Exact Mass223.10
IUPAC NameN-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide
SMILESCNC(=O)CCC(=O)Cn1ncccc1=O
InChIInChI=1S/C10H13N3O3/c1-11-9(15)5-4-8(14)7-13-10(16)3-2-6-12-13/h2-3,6H,4-5,7H2,1H3,(H,11,15)
InChIKeyNAHIDDYZJONLQO-UHFFFAOYSA-N
XLogP-0.66
TPSA81.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.23
LogP ≤ 5-0.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide?
The IUPAC name of N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide (CID 139772198) is N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide.
What is the SMILES notation for N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide?
The canonical SMILES for N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide is CNC(=O)CCC(=O)Cn1ncccc1=O.
What is the InChIKey of N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide?
The InChIKey is NAHIDDYZJONLQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O3/c1-11-9(15)5-4-8(14)7-13-10(16)3-2-6-12-13/h2-3,6H,4-5,7H2,1H3,(H,11,15).
What are the key properties of N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide?
N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide has a molecular weight of 223.23 g/mol, XLogP of -0.66, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-oxo-5-(6-oxopyridazin-1-yl)pentanamide is sourced from PubChem (CID 139772198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).