N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

C19H24N4O3 — CID 4060999

IUPACN-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)NCCCN1CCOCC1
InChIInChI=1S/C19H24N4O3/c24-18(20-9-4-10-22-11-13-26-14-12-22)15-23-19(25)8-7-17(21-23)16-5-2-1-3-6-16/h1-3,5-8H,4,9-15H2,(H,20,24)
InChIKeyLWDFAAPPFPINFH-UHFFFAOYSA-N
MW356.43 g/mol
LogP0.75
Rot. Bonds7

About N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide

N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (PubChem CID 4060999) has the molecular formula C19H24N4O3 and a molecular weight of 356.43 g/mol. Its IUPAC name is N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
PubChem CID4060999
Molecular FormulaC19H24N4O3
Molecular Weight356.43 g/mol
Exact Mass356.18
IUPAC NameN-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)ccc1=O)NCCCN1CCOCC1
InChIInChI=1S/C19H24N4O3/c24-18(20-9-4-10-22-11-13-26-14-12-22)15-23-19(25)8-7-17(21-23)16-5-2-1-3-6-16/h1-3,5-8H,4,9-15H2,(H,20,24)
InChIKeyLWDFAAPPFPINFH-UHFFFAOYSA-N
XLogP0.75
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.43
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The IUPAC name of N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide (CID 4060999) is N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide.
What is the SMILES notation for N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The canonical SMILES for N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is O=C(Cn1nc(-c2ccccc2)ccc1=O)NCCCN1CCOCC1.
What is the InChIKey of N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
The InChIKey is LWDFAAPPFPINFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N4O3/c24-18(20-9-4-10-22-11-13-26-14-12-22)15-23-19(25)8-7-17(21-23)16-5-2-1-3-6-16/h1-3,5-8H,4,9-15H2,(H,20,24).
What are the key properties of N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide?
N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide has a molecular weight of 356.43 g/mol, XLogP of 0.75, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-morpholin-4-ylpropyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide is sourced from PubChem (CID 4060999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).