3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide

C20H24N2O3 — CID 46415307

IUPAC3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(N2CCOCC2)ccc1NC(=O)CCc1ccccc1O
InChIInChI=1S/C20H24N2O3/c1-15-14-17(22-10-12-25-13-11-22)7-8-18(15)21-20(24)9-6-16-4-2-3-5-19(16)23/h2-5,7-8,14,23H,6,9-13H2,1H3,(H,21,24)
InChIKeyDGXGYHGLPXHVMU-UHFFFAOYSA-N
MW340.42 g/mol
LogP3.11
Rot. Bonds5

About 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide

3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide (PubChem CID 46415307) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide
PubChem CID46415307
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(N2CCOCC2)ccc1NC(=O)CCc1ccccc1O
InChIInChI=1S/C20H24N2O3/c1-15-14-17(22-10-12-25-13-11-22)7-8-18(15)21-20(24)9-6-16-4-2-3-5-19(16)23/h2-5,7-8,14,23H,6,9-13H2,1H3,(H,21,24)
InChIKeyDGXGYHGLPXHVMU-UHFFFAOYSA-N
XLogP3.11
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide (CID 46415307) is 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide is Cc1cc(N2CCOCC2)ccc1NC(=O)CCc1ccccc1O.
What is the InChIKey of 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The InChIKey is DGXGYHGLPXHVMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-15-14-17(22-10-12-25-13-11-22)7-8-18(15)21-20(24)9-6-16-4-2-3-5-19(16)23/h2-5,7-8,14,23H,6,9-13H2,1H3,(H,21,24).
What are the key properties of 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide has a molecular weight of 340.42 g/mol, XLogP of 3.11, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-hydroxyphenyl)-N-(2-methyl-4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 46415307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).