N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide

C22H24N4O3 — CID 662299

IUPACN-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide
SMILESCCC(=O)Nc1cc(-c2nnc(OC)c3ccccc23)ccc1N1CCOCC1
InChIInChI=1S/C22H24N4O3/c1-3-20(27)23-18-14-15(8-9-19(18)26-10-12-29-13-11-26)21-16-6-4-5-7-17(16)22(28-2)25-24-21/h4-9,14H,3,10-13H2,1-2H3,(H,23,27)
InChIKeyGYLJTFVIZPJWKS-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.49
Rot. Bonds5

About N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide

N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide (PubChem CID 662299) has the molecular formula C22H24N4O3 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide.

Molecular Properties

Compound NameN-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide
PubChem CID662299
Molecular FormulaC22H24N4O3
Molecular Weight392.46 g/mol
Exact Mass392.18
IUPAC NameN-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide
SMILESCCC(=O)Nc1cc(-c2nnc(OC)c3ccccc23)ccc1N1CCOCC1
InChIInChI=1S/C22H24N4O3/c1-3-20(27)23-18-14-15(8-9-19(18)26-10-12-29-13-11-26)21-16-6-4-5-7-17(16)22(28-2)25-24-21/h4-9,14H,3,10-13H2,1-2H3,(H,23,27)
InChIKeyGYLJTFVIZPJWKS-UHFFFAOYSA-N
XLogP3.49
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(4-Methoxy-1-phthalazinyl)-2-(1-piperidinyl)aniline
CID 2953423
N-[5-(4-methoxyphthalazin-1-yl)-2-(morpholin-4-yl)phenyl]acetamide
CID 662471
N-[5-(4-methoxy-1-phthalazinyl)-2-(4-morpholinyl)phenyl]cyclohexanecarboxamide
CID 2945285
N-[5-(4-methoxy-1-phthalazinyl)-2-(4-morpholinyl)phenyl]-2-furamide
CID 2945487
N-[5-(4-Methoxy-phthalazin-1-yl)-2-morpholin-4-yl-phenyl]-benzamide
CID 3154339
4-chloro-N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzamide
CID 6407021
N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]cyclohexanecarboxamide
CID 6407393
N-[5-(4-methoxy-1-phthalazinyl)-2-(4-morpholinyl)phenyl]-4-methylbenzamide
CID 2945880
2-chloro-N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzamide
CID 2953044
N-[5-(4-Methoxy-phthalazin-1-yl)-2-piperidin-1-yl-phenyl]-acetamide
CID 3155247
N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]benzamide
CID 6407400
N-[5-(4-methoxyphthalazin-1-yl)-2-(piperidin-1-yl)phenyl]butanamide
CID 2953328

Frequently Asked Questions

What is the IUPAC name of N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide?
The IUPAC name of N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide (CID 662299) is N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide.
What is the SMILES notation for N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide?
The canonical SMILES for N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide is CCC(=O)Nc1cc(-c2nnc(OC)c3ccccc23)ccc1N1CCOCC1.
What is the InChIKey of N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide?
The InChIKey is GYLJTFVIZPJWKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O3/c1-3-20(27)23-18-14-15(8-9-19(18)26-10-12-29-13-11-26)21-16-6-4-5-7-17(16)22(28-2)25-24-21/h4-9,14H,3,10-13H2,1-2H3,(H,23,27).
What are the key properties of N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide?
N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide has a molecular weight of 392.46 g/mol, XLogP of 3.49, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(4-methoxyphthalazin-1-yl)-2-morpholin-4-ylphenyl]propanamide is sourced from PubChem (CID 662299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).