N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide

C18H22N4O3 — CID 53200813

IUPACN-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide
SMILESCCn1ncc(NC(=O)c2ccc(C)cc2)c(N2CCOCC2)c1=O
InChIInChI=1S/C18H22N4O3/c1-3-22-18(24)16(21-8-10-25-11-9-21)15(12-19-22)20-17(23)14-6-4-13(2)5-7-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,23)
InChIKeyWSHUDQHWCDARQO-UHFFFAOYSA-N
MW342.40 g/mol
LogP1.66
Rot. Bonds4

About N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide

N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide (PubChem CID 53200813) has the molecular formula C18H22N4O3 and a molecular weight of 342.40 g/mol. Its IUPAC name is N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide.

Molecular Properties

Compound NameN-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide
PubChem CID53200813
Molecular FormulaC18H22N4O3
Molecular Weight342.40 g/mol
Exact Mass342.17
IUPAC NameN-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide
SMILESCCn1ncc(NC(=O)c2ccc(C)cc2)c(N2CCOCC2)c1=O
InChIInChI=1S/C18H22N4O3/c1-3-22-18(24)16(21-8-10-25-11-9-21)15(12-19-22)20-17(23)14-6-4-13(2)5-7-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,23)
InChIKeyWSHUDQHWCDARQO-UHFFFAOYSA-N
XLogP1.66
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(1-ethyl-6-oxo-5-piperidin-1-ylpyridazin-4-yl)-4-methylbenzamide
CID 53200795
N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-3,4,5-trimethoxybenzamide
CID 53200828
N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]-4-methoxybenzamide
CID 19338897
3-[(4-methylbenzoyl)amino]-4-morpholin-4-ylbenzoic acid
CID 53052846
N-[4-(dimethylamino)-2-morpholin-4-ylpyrimidin-5-yl]-4-methylbenzamide
CID 91969402
3,4-diethoxy-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]benzamide
CID 19338842
4-[(4-bromo-3,5-dimethylpyrazol-1-yl)methyl]-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]benzamide
CID 19338974
3-[4-[[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]carbamoyl]pyrazol-1-yl]propanoic acid
CID 19471371
4-methyl-N-[1-(2-morpholin-4-ylethyl)pyrazol-4-yl]benzamide
CID 121419957
4-ethyl-N-(2-morpholin-4-ylpyrimidin-5-yl)benzamide
CID 53164786
ethyl 5-[(4-methylbenzoyl)amino]-2-morpholin-4-ylbenzoate
CID 7328776
2-chloro-N-[1-ethyl-5-(morpholine-4-carbonyl)pyrazol-4-yl]benzamide
CID 19338846

Frequently Asked Questions

What is the IUPAC name of N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide?
The IUPAC name of N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide (CID 53200813) is N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide.
What is the SMILES notation for N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide?
The canonical SMILES for N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide is CCn1ncc(NC(=O)c2ccc(C)cc2)c(N2CCOCC2)c1=O.
What is the InChIKey of N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide?
The InChIKey is WSHUDQHWCDARQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N4O3/c1-3-22-18(24)16(21-8-10-25-11-9-21)15(12-19-22)20-17(23)14-6-4-13(2)5-7-14/h4-7,12H,3,8-11H2,1-2H3,(H,20,23).
What are the key properties of N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide?
N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide has a molecular weight of 342.40 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethyl-5-morpholin-4-yl-6-oxopyridazin-4-yl)-4-methylbenzamide is sourced from PubChem (CID 53200813), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).