N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide

C6H8N4O3 — CID 13221217

IUPACN-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide
SMILESCC(=O)Nc1c(N)c(=O)[nH][nH]c1=O
InChIInChI=1S/C6H8N4O3/c1-2(11)8-4-3(7)5(12)9-10-6(4)13/h1H3,(H3,7,10,13)(H2,8,9,11,12)
InChIKeySEJFKIVPWVAMBF-UHFFFAOYSA-N
MW184.16 g/mol
LogP-1.40
Rot. Bonds1

About N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide

N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide (PubChem CID 13221217) has the molecular formula C6H8N4O3 and a molecular weight of 184.16 g/mol. Its IUPAC name is N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide
PubChem CID13221217
Molecular FormulaC6H8N4O3
Molecular Weight184.16 g/mol
Exact Mass184.06
IUPAC NameN-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide
SMILESCC(=O)Nc1c(N)c(=O)[nH][nH]c1=O
InChIInChI=1S/C6H8N4O3/c1-2(11)8-4-3(7)5(12)9-10-6(4)13/h1H3,(H3,7,10,13)(H2,8,9,11,12)
InChIKeySEJFKIVPWVAMBF-UHFFFAOYSA-N
XLogP-1.40
TPSA120.84 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.16
LogP ≤ 5-1.40
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide?
The IUPAC name of N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide (CID 13221217) is N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide.
What is the SMILES notation for N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide?
The canonical SMILES for N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide is CC(=O)Nc1c(N)c(=O)[nH][nH]c1=O.
What is the InChIKey of N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide?
The InChIKey is SEJFKIVPWVAMBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N4O3/c1-2(11)8-4-3(7)5(12)9-10-6(4)13/h1H3,(H3,7,10,13)(H2,8,9,11,12).
What are the key properties of N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide?
N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide has a molecular weight of 184.16 g/mol, XLogP of -1.40, 1 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-3,6-dioxo-1,2-dihydropyridazin-4-yl)acetamide is sourced from PubChem (CID 13221217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).