N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide

C25H28N4O3 — CID 52898033

IUPACN-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(N2CCOCC2)ccc1=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N4O3/c30-24(19-29-25(31)12-11-23(27-29)28-15-17-32-18-16-28)26-14-13-22(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,22H,13-19H2,(H,26,30)
InChIKeyYHZISTUHVOEBRL-UHFFFAOYSA-N
MW432.52 g/mol
LogP2.42
Rot. Bonds8

About N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide

N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide (PubChem CID 52898033) has the molecular formula C25H28N4O3 and a molecular weight of 432.52 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
PubChem CID52898033
Molecular FormulaC25H28N4O3
Molecular Weight432.52 g/mol
Exact Mass432.22
IUPAC NameN-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
SMILESO=C(Cn1nc(N2CCOCC2)ccc1=O)NCCC(c1ccccc1)c1ccccc1
InChIInChI=1S/C25H28N4O3/c30-24(19-29-25(31)12-11-23(27-29)28-15-17-32-18-16-28)26-14-13-22(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,22H,13-19H2,(H,26,30)
InChIKeyYHZISTUHVOEBRL-UHFFFAOYSA-N
XLogP2.42
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.52
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-(2-phenylethyl)acetamide
CID 51052835
N-cyclohexyl-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide
CID 51054544
N-(2-morpholin-4-ylethyl)-2-(6-oxo-3-phenylpyridazin-1-yl)acetamide
CID 5053341
N-(3,3-diphenylpropyl)-2-(6-oxo-3-pyridin-4-ylpyridazin-1-yl)acetamide
CID 121052709
N-ethyl-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]acetamide
CID 53023501
N-(3,3-diphenylpropyl)-2-(6-oxo-3-pyridin-3-ylpyridazin-1-yl)acetamide
CID 121052463
N-(3,3-diphenylpropyl)-2-(3-oxo-5,6,7,8-tetrahydrocinnolin-2-yl)acetamide
CID 52900698
N-benzyl-2-(6-oxo-3-thiomorpholin-4-ylpyridazin-1-yl)acetamide
CID 53368198
2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)-N-(1,3-thiazol-2-yl)acetamide
CID 52901513
2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-6-morpholin-4-ylpyridazin-3-one
CID 52901373
N-(3,3-diphenylpropyl)-2-[3-(4-ethoxyphenyl)-6-oxopyridazin-1-yl]acetamide
CID 121050455
N-[2-(cyclohexen-1-yl)ethyl]-2-[6-oxo-3-(4-phenylpiperazin-1-yl)pyridazin-1-yl]acetamide
CID 51043011

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The IUPAC name of N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide (CID 52898033) is N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide is O=C(Cn1nc(N2CCOCC2)ccc1=O)NCCC(c1ccccc1)c1ccccc1.
What is the InChIKey of N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
The InChIKey is YHZISTUHVOEBRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28N4O3/c30-24(19-29-25(31)12-11-23(27-29)28-15-17-32-18-16-28)26-14-13-22(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,22H,13-19H2,(H,26,30).
What are the key properties of N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide?
N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide has a molecular weight of 432.52 g/mol, XLogP of 2.42, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-2-(3-morpholin-4-yl-6-oxopyridazin-1-yl)acetamide is sourced from PubChem (CID 52898033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).