N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide

C15H24N4O3 — CID 95729428

IUPACN-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCC[C@@H]1CN(c2cnn(C)c(=O)c2)CCO1
InChIInChI=1S/C15H24N4O3/c1-3-4-14(20)16-6-5-13-11-19(7-8-22-13)12-9-15(21)18(2)17-10-12/h9-10,13H,3-8,11H2,1-2H3,(H,16,20)/t13-/m1/s1
InChIKeyMFKOOWYAIFVJGH-CYBMUJFWSA-N
MW308.38 g/mol
LogP0.29
Rot. Bonds6

About N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide

N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide (PubChem CID 95729428) has the molecular formula C15H24N4O3 and a molecular weight of 308.38 g/mol. Its IUPAC name is N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide.

Molecular Properties

Compound NameN-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide
PubChem CID95729428
Molecular FormulaC15H24N4O3
Molecular Weight308.38 g/mol
Exact Mass308.18
IUPAC NameN-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide
SMILESCCCC(=O)NCC[C@@H]1CN(c2cnn(C)c(=O)c2)CCO1
InChIInChI=1S/C15H24N4O3/c1-3-4-14(20)16-6-5-13-11-19(7-8-22-13)12-9-15(21)18(2)17-10-12/h9-10,13H,3-8,11H2,1-2H3,(H,16,20)/t13-/m1/s1
InChIKeyMFKOOWYAIFVJGH-CYBMUJFWSA-N
XLogP0.29
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

1-methyl-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}-4-piperidinecarboxamide
CID 56891455
2-hydroxy-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}acetamide
CID 56898251
N-(tert-butyl)-N'-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}urea
CID 70717227
2-methoxy-N-{[1-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-4-piperidinyl]methyl}butanamide
CID 70726045
Propyl {2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}carbamate
CID 70730611
N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}-1-piperidinecarboxamide
CID 70756598
1-(1-Methyl-6-oxo-16-dihydropyridazin-4-YL)-N-[3-(propan-2-yloxy)propyl]piperidine-4-carboxamide
CID 53202084
1-(6-Oxo-1-propyl-1,6-dihydropyridazin-4-YL)-N-[3-(propan-2-yloxy)propyl]piperidine-4-carboxamide
CID 53202153
N-(3-ethoxypropyl)-1-(6-oxo-1-propyl-1,6-dihydropyridazin-4-yl)piperidine-4-carboxamide
CID 53202164
N-(2-methoxyethyl)-1-(6-oxo-1-propyl-1,6-dihydropyridazin-4-yl)piperidine-4-carboxamide
CID 53202193
1-methyl-N-{2-[4-(1-methyl-6-oxo-1,6-dihydro-4-pyridazinyl)-2-morpholinyl]ethyl}cyclopropanecarboxamide
CID 56885150
2-[4-[2-(2-aminoethyl)-4-morpholinyl]-6-oxo-1(6H)-pyridazinyl]-N-ethyl-N-methylacetamide
CID 56892429

Frequently Asked Questions

What is the IUPAC name of N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide?
The IUPAC name of N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide (CID 95729428) is N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide.
What is the SMILES notation for N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide?
The canonical SMILES for N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide is CCCC(=O)NCC[C@@H]1CN(c2cnn(C)c(=O)c2)CCO1.
What is the InChIKey of N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide?
The InChIKey is MFKOOWYAIFVJGH-CYBMUJFWSA-N. The full InChI is InChI=1S/C15H24N4O3/c1-3-4-14(20)16-6-5-13-11-19(7-8-22-13)12-9-15(21)18(2)17-10-12/h9-10,13H,3-8,11H2,1-2H3,(H,16,20)/t13-/m1/s1.
What are the key properties of N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide?
N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide has a molecular weight of 308.38 g/mol, XLogP of 0.29, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[(2R)-4-(1-methyl-6-oxopyridazin-4-yl)morpholin-2-yl]ethyl]butanamide is sourced from PubChem (CID 95729428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).