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

C15H22N2O2 — CID 50896215

IUPAC2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(NC(=O)C(C)C)ccc1N1CCOCC1
InChIInChI=1S/C15H22N2O2/c1-11(2)15(18)16-13-4-5-14(12(3)10-13)17-6-8-19-9-7-17/h4-5,10-11H,6-9H2,1-3H3,(H,16,18)
InChIKeyXWQUNNPIXWONLF-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.43
Rot. Bonds3

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

2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide (PubChem CID 50896215) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
PubChem CID50896215
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(NC(=O)C(C)C)ccc1N1CCOCC1
InChIInChI=1S/C15H22N2O2/c1-11(2)15(18)16-13-4-5-14(12(3)10-13)17-6-8-19-9-7-17/h4-5,10-11H,6-9H2,1-3H3,(H,16,18)
InChIKeyXWQUNNPIXWONLF-UHFFFAOYSA-N
XLogP2.43
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.43
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-amino-4-morpholin-4-ylphenyl)-2-methylpropanamide
CID 28688940
N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
CID 50896207
(2R)-2-chloro-N-(4-methyl-3-morpholin-4-ylphenyl)propanamide
CID 51670668
N-(2-amino-4-methyl-5-morpholin-4-ylphenyl)-2-methylpropanamide
CID 91683940
2-methyl-N-[4-[(6-methyl-2-morpholin-4-ylpyrimidin-4-yl)amino]phenyl]propanamide
CID 53047890
2-methyl-N-(2-morpholin-4-ylphenyl)propanamide
CID 2767049
3-(3-but-3-ynyldiazirin-3-yl)-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide
CID 154771793
N-(3-amino-4-piperidin-1-ylphenyl)-2-methylpropanamide
CID 91676092
3-methyl-N-[3-methyl-4-(2-oxopyrrolidin-1-yl)phenyl]-4-morpholin-4-ylbenzamide
CID 131952772
(2R)-2-[4-(2-methylphenyl)piperazin-1-ium-1-yl]-N-(4-morpholin-4-ylphenyl)propanamide
CID 8725307
N-(3-amino-4-morpholin-4-ylphenyl)acetamide
CID 42560587
methyl 3-methyl-4-morpholin-4-ylbenzoate
CID 67528858

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide (CID 50896215) is 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide is Cc1cc(NC(=O)C(C)C)ccc1N1CCOCC1.
What is the InChIKey of 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
The InChIKey is XWQUNNPIXWONLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11(2)15(18)16-13-4-5-14(12(3)10-13)17-6-8-19-9-7-17/h4-5,10-11H,6-9H2,1-3H3,(H,16,18).
What are the key properties of 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide?
2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide has a molecular weight of 262.35 g/mol, XLogP of 2.43, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(3-methyl-4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 50896215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).