N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide

C19H18N4O3 — CID 126938792

IUPACN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2ccc3ncccc3c2)n1
InChIInChI=1S/C19H18N4O3/c1-12-4-7-18(24)23(22-12)17-11-26-10-16(17)21-19(25)14-5-6-15-13(9-14)3-2-8-20-15/h2-9,16-17H,10-11H2,1H3,(H,21,25)
InChIKeyAXLRRUDSVKPZKG-UHFFFAOYSA-N
MW350.38 g/mol
LogP1.47
Rot. Bonds3

About N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide

N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide (PubChem CID 126938792) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide.

Molecular Properties

Compound NameN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide
PubChem CID126938792
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC NameN-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide
SMILESCc1ccc(=O)n(C2COCC2NC(=O)c2ccc3ncccc3c2)n1
InChIInChI=1S/C19H18N4O3/c1-12-4-7-18(24)23(22-12)17-11-26-10-16(17)21-19(25)14-5-6-15-13(9-14)3-2-8-20-15/h2-9,16-17H,10-11H2,1H3,(H,21,25)
InChIKeyAXLRRUDSVKPZKG-UHFFFAOYSA-N
XLogP1.47
TPSA86.11 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[4-(6-oxo-3-pyrazol-1-ylpyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide
CID 126940448
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-pyrrolo[2,3-b]pyridine-3-carboxamide
CID 126938910
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]indolizine-2-carboxamide
CID 126938783
2-methyl-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]imidazo[1,2-a]pyridine-3-carboxamide
CID 126938763
5-bromo-N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]thiophene-2-carboxamide
CID 126938917
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]-1H-indole-4-carboxamide
CID 126938795
N-[4-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)oxolan-3-yl]-1H-indole-5-carboxamide
CID 126940248
N-[(1R,2R,3R)-2-hydroxy-3-pyrrolidin-1-ylcycloheptyl]quinoline-6-carboxamide
CID 110128202
2-methyl-N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)oxolan-3-yl]-1,3-thiazole-4-carboxamide
CID 126940053
6-[[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]amino]pyridine-3-carbonitrile
CID 126938812
N-(4-methoxypyrrolidin-3-yl)quinoline-6-carboxamide
CID 76975241
N-[4-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)oxolan-3-yl]-1-benzofuran-2-carboxamide
CID 126940035

Frequently Asked Questions

What is the IUPAC name of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide?
The IUPAC name of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide (CID 126938792) is N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide.
What is the SMILES notation for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide?
The canonical SMILES for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide is Cc1ccc(=O)n(C2COCC2NC(=O)c2ccc3ncccc3c2)n1.
What is the InChIKey of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide?
The InChIKey is AXLRRUDSVKPZKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-12-4-7-18(24)23(22-12)17-11-26-10-16(17)21-19(25)14-5-6-15-13(9-14)3-2-8-20-15/h2-9,16-17H,10-11H2,1H3,(H,21,25).
What are the key properties of N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide?
N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide has a molecular weight of 350.38 g/mol, XLogP of 1.47, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(3-methyl-6-oxopyridazin-1-yl)oxolan-3-yl]quinoline-6-carboxamide is sourced from PubChem (CID 126938792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).