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

C14H20N2O2 — CID 50896207

IUPACN-(3-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(N2CCOCC2)c(C)c1
InChIInChI=1S/C14H20N2O2/c1-3-14(17)15-12-4-5-13(11(2)10-12)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyQFOYKZMKJVHIIM-UHFFFAOYSA-N
MW248.33 g/mol
LogP2.18
Rot. Bonds3

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

N-(3-methyl-4-morpholin-4-ylphenyl)propanamide (PubChem CID 50896207) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is N-(3-methyl-4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound NameN-(3-methyl-4-morpholin-4-ylphenyl)propanamide
PubChem CID50896207
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC NameN-(3-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCCC(=O)Nc1ccc(N2CCOCC2)c(C)c1
InChIInChI=1S/C14H20N2O2/c1-3-14(17)15-12-4-5-13(11(2)10-12)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17)
InChIKeyQFOYKZMKJVHIIM-UHFFFAOYSA-N
XLogP2.18
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-fluoro-4-morpholin-4-ylphenyl)propanamide
CID 144950070
2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
CID 50896215
N-(3,4-dimethylphenyl)-N'-(2-morpholin-4-ylphenyl)propanediamide
CID 108953647
3-(3-but-3-ynyldiazirin-3-yl)-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
CID 154771793
N-(3-chloro-4-morpholin-4-ylphenyl)-3-methylbutanamide
CID 960696
N-[3-methyl-4-[3-(4-morpholin-4-ylphenyl)propylsulfamoyl]phenyl]propanamide
CID 16891034
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]propanamide
CID 2996154
3-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-morpholin-4-ylbenzamide
CID 131952772
N-[3-methyl-4-[2-methyl-4-(propanoylamino)phenyl]phenyl]propanamide
CID 4316551
N-(3,4-dimethylphenyl)-3-(4-morpholin-4-ylphenyl)propanamide
CID 110649726
methyl 3-methyl-4-morpholin-4-ylbenzoate
CID 67528858
N-(3-amino-4-morpholin-4-ylphenyl)acetamide
CID 42560587

Frequently Asked Questions

What is the IUPAC name of N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of N-(3-methyl-4-morpholin-4-ylphenyl)propanamide (CID 50896207) is N-(3-methyl-4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for N-(3-methyl-4-morpholin-4-ylphenyl)propanamide is CCC(=O)Nc1ccc(N2CCOCC2)c(C)c1.
What is the InChIKey of N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The InChIKey is QFOYKZMKJVHIIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-3-14(17)15-12-4-5-13(11(2)10-12)16-6-8-18-9-7-16/h4-5,10H,3,6-9H2,1-2H3,(H,15,17).
What are the key properties of N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
N-(3-methyl-4-morpholin-4-ylphenyl)propanamide has a molecular weight of 248.33 g/mol, XLogP of 2.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methyl-4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 50896207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).