N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide

C10H12N4O3 — CID 110745997

IUPACN-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCN1CC(NC(=O)c2ccc(=O)[nH]n2)CC1=O
InChIInChI=1S/C10H12N4O3/c1-14-5-6(4-9(14)16)11-10(17)7-2-3-8(15)13-12-7/h2-3,6H,4-5H2,1H3,(H,11,17)(H,13,15)
InChIKeyFWUOOTDJSMTPJY-UHFFFAOYSA-N
MW236.23 g/mol
LogP-1.27
Rot. Bonds2

About N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide

N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 110745997) has the molecular formula C10H12N4O3 and a molecular weight of 236.23 g/mol. Its IUPAC name is N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID110745997
Molecular FormulaC10H12N4O3
Molecular Weight236.23 g/mol
Exact Mass236.09
IUPAC NameN-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide
SMILESCN1CC(NC(=O)c2ccc(=O)[nH]n2)CC1=O
InChIInChI=1S/C10H12N4O3/c1-14-5-6(4-9(14)16)11-10(17)7-2-3-8(15)13-12-7/h2-3,6H,4-5H2,1H3,(H,11,17)(H,13,15)
InChIKeyFWUOOTDJSMTPJY-UHFFFAOYSA-N
XLogP-1.27
TPSA95.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.23
LogP ≤ 5-1.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-(dimethylamino)propyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 1932907
2-[(6-oxo-1H-pyridazine-3-carbonyl)amino]propanediamide
CID 30692494
N-(1-cyclopropyl-5-oxopyrrolidin-3-yl)-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 71789177
N-[(6-oxo-1H-pyridazin-3-yl)methyl]butanamide
CID 154267906
Ethane;6-methyl-2-[(4-oxoazetidin-2-yl)methyl]pyridazin-3-one
CID 171811472
5-(1-methyl-2-oxoimidazolidin-4-yl)-1H-pyridazin-6-one
CID 173086729
dimethyl-[3-[(6-oxo-1H-pyridazine-3-carbonyl)amino]propyl]azanium
CID 1932906
6-oxo-N-[3-(2-oxopyrrolidin-1-yl)propyl]-1H-pyridazine-3-carboxamide
CID 30482081
6-oxo-N-[2-oxo-2-(propan-2-ylamino)ethyl]-1H-pyridazine-3-carboxamide
CID 30539711
N-[2-[di(propan-2-yl)amino]ethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 30888141
N-(2-acetamidoethyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 35052158
N-[2-(dimethylamino)-2-oxoethyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 35348833

Frequently Asked Questions

What is the IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide (CID 110745997) is N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide is CN1CC(NC(=O)c2ccc(=O)[nH]n2)CC1=O.
What is the InChIKey of N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is FWUOOTDJSMTPJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O3/c1-14-5-6(4-9(14)16)11-10(17)7-2-3-8(15)13-12-7/h2-3,6H,4-5H2,1H3,(H,11,17)(H,13,15).
What are the key properties of N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide?
N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 236.23 g/mol, XLogP of -1.27, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methyl-5-oxopyrrolidin-3-yl)-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 110745997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).