N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide

C10H11N3O2 — CID 103762323

IUPACN-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CC=CC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H11N3O2/c14-9-6-5-8(12-13-9)10(15)11-7-3-1-2-4-7/h1-2,5-7H,3-4H2,(H,11,15)(H,13,14)
InChIKeyIXDJUQVICVYNFZ-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.22
Rot. Bonds2

About N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide

N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide (PubChem CID 103762323) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide
PubChem CID103762323
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC NameN-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide
SMILESO=C(NC1CC=CC1)c1ccc(=O)[nH]n1
InChIInChI=1S/C10H11N3O2/c14-9-6-5-8(12-13-9)10(15)11-7-3-1-2-4-7/h1-2,5-7H,3-4H2,(H,11,15)(H,13,14)
InChIKeyIXDJUQVICVYNFZ-UHFFFAOYSA-N
XLogP0.22
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-[3-(dimethylamino)propyl]-6-oxo-1H-pyridazine-3-carboxamide
CID 1932907
N-cycloheptyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 940468
N-isopropyl-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 42443181
N-cyclopentyl-1-methyl-6-oxo-1,6-dihydropyridazine-3-carboxamide
CID 9168301
N-[(2S)-3-methylbutan-2-yl]-6-oxo-N-prop-2-enyl-1H-pyridazine-3-carboxamide
CID 40151649
2,2-difluoro-N-[(6-oxo-1H-pyridazin-3-yl)methyl]propanamide
CID 170266150
N-((1r,4r)-4-aminocyclohexyl)-6-hydroxypyridazine-3-carboxamide
CID 103806098
6-oxo-N-(3,3,3-trifluoropropyl)-1H-pyridazine-3-carboxamide
CID 103709585
6-oxo-N-(4,4,4-trifluorobutyl)-1H-pyridazine-3-carboxamide
CID 103713365
6-oxo-N-(4,4,4-trifluorobutan-2-yl)-1H-pyridazine-3-carboxamide
CID 104854846
N-(3-amino-2,2-difluoropropyl)-6-oxo-1H-pyridazine-3-carboxamide
CID 104954941
6-oxo-N-[3-[(2,2,2-trifluoroacetyl)amino]propyl]-1H-pyridazine-3-carboxamide
CID 108934838

Frequently Asked Questions

What is the IUPAC name of N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide?
The IUPAC name of N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide (CID 103762323) is N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide.
What is the SMILES notation for N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide?
The canonical SMILES for N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide is O=C(NC1CC=CC1)c1ccc(=O)[nH]n1.
What is the InChIKey of N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide?
The InChIKey is IXDJUQVICVYNFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c14-9-6-5-8(12-13-9)10(15)11-7-3-1-2-4-7/h1-2,5-7H,3-4H2,(H,11,15)(H,13,14).
What are the key properties of N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide?
N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide has a molecular weight of 205.22 g/mol, XLogP of 0.22, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopent-3-en-1-yl-6-oxo-1H-pyridazine-3-carboxamide is sourced from PubChem (CID 103762323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).