N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide

C19H19N3O3 — CID 121076093

IUPACN-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide
SMILESCC(C(=O)N(C)Cc1ccccc1)n1nc(-c2ccco2)ccc1=O
InChIInChI=1S/C19H19N3O3/c1-14(19(24)21(2)13-15-7-4-3-5-8-15)22-18(23)11-10-16(20-22)17-9-6-12-25-17/h3-12,14H,13H2,1-2H3
InChIKeyFEPWDSOMPWHRQR-UHFFFAOYSA-N
MW337.38 g/mol
LogP2.72
Rot. Bonds5

About N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide

N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide (PubChem CID 121076093) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide.

Molecular Properties

Compound NameN-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide
PubChem CID121076093
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC NameN-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide
SMILESCC(C(=O)N(C)Cc1ccccc1)n1nc(-c2ccco2)ccc1=O
InChIInChI=1S/C19H19N3O3/c1-14(19(24)21(2)13-15-7-4-3-5-8-15)22-18(23)11-10-16(20-22)17-9-6-12-25-17/h3-12,14H,13H2,1-2H3
InChIKeyFEPWDSOMPWHRQR-UHFFFAOYSA-N
XLogP2.72
TPSA68.34 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(2-phenylethyl)propanamide
CID 121076114
2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-[2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]ethyl]propanamide
CID 121076228
2-[1-(4-acetylpiperazin-1-yl)-1-oxopropan-2-yl]-6-(furan-2-yl)pyridazin-3-one
CID 121076220
N-benzyl-3-(furan-2-yl)-N,1-dimethylpyrazole-5-carboxamide
CID 42879277
2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(pyridin-2-ylmethyl)propanamide
CID 56723989
N,N-dibenzyl-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)propanamide
CID 121101195
6-(furan-2-yl)-2-[1-(2-methyl-2,3-dihydroindol-1-yl)-1-oxopropan-2-yl]pyridazin-3-one
CID 121075997
2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-[2-(2-methoxyphenyl)ethyl]propanamide
CID 121076062
2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-(1,2-oxazol-3-yl)propanamide
CID 121076102
N,N-dibenzyl-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)propanamide
CID 121100938
N-[1-[benzyl(methyl)amino]-1-oxopropan-2-yl]furan-2-carboxamide
CID 51147843
2-[[4-amino-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-benzyl-N-methylpropanamide
CID 42969549

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide?
The IUPAC name of N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide (CID 121076093) is N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide.
What is the SMILES notation for N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide?
The canonical SMILES for N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide is CC(C(=O)N(C)Cc1ccccc1)n1nc(-c2ccco2)ccc1=O.
What is the InChIKey of N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide?
The InChIKey is FEPWDSOMPWHRQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-14(19(24)21(2)13-15-7-4-3-5-8-15)22-18(23)11-10-16(20-22)17-9-6-12-25-17/h3-12,14H,13H2,1-2H3.
What are the key properties of N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide?
N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide has a molecular weight of 337.38 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-[3-(furan-2-yl)-6-oxopyridazin-1-yl]-N-methylpropanamide is sourced from PubChem (CID 121076093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).