N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide

C20H20N4O3 — CID 3473975

IUPACN-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)NN1CCOCC1
InChIInChI=1S/C20H20N4O3/c25-18(21-23-10-12-27-13-11-23)14-24-20(26)17-9-5-4-8-16(17)19(22-24)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,21,25)
InChIKeyNUGKTZYCTNQSML-UHFFFAOYSA-N
MW364.40 g/mol
LogP1.43
Rot. Bonds4

About N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide

N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide (PubChem CID 3473975) has the molecular formula C20H20N4O3 and a molecular weight of 364.40 g/mol. Its IUPAC name is N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide.

Molecular Properties

Compound NameN-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide
PubChem CID3473975
Molecular FormulaC20H20N4O3
Molecular Weight364.40 g/mol
Exact Mass364.15
IUPAC NameN-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide
SMILESO=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)NN1CCOCC1
InChIInChI=1S/C20H20N4O3/c25-18(21-23-10-12-27-13-11-23)14-24-20(26)17-9-5-4-8-16(17)19(22-24)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,21,25)
InChIKeyNUGKTZYCTNQSML-UHFFFAOYSA-N
XLogP1.43
TPSA76.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.40
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide?
The IUPAC name of N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide (CID 3473975) is N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide.
What is the SMILES notation for N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide?
The canonical SMILES for N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide is O=C(Cn1nc(-c2ccccc2)c2ccccc2c1=O)NN1CCOCC1.
What is the InChIKey of N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide?
The InChIKey is NUGKTZYCTNQSML-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O3/c25-18(21-23-10-12-27-13-11-23)14-24-20(26)17-9-5-4-8-16(17)19(22-24)15-6-2-1-3-7-15/h1-9H,10-14H2,(H,21,25).
What are the key properties of N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide?
N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide has a molecular weight of 364.40 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-morpholin-4-yl-2-(1-oxo-4-phenylphthalazin-2-yl)acetamide is sourced from PubChem (CID 3473975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).