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

C14H20N2O2 — CID 142676470

IUPAC2-(2-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(N2CCOCC2)ccc1C(C)C(N)=O
InChIInChI=1S/C14H20N2O2/c1-10-9-12(16-5-7-18-8-6-16)3-4-13(10)11(2)14(15)17/h3-4,9,11H,5-8H2,1-2H3,(H2,15,17)
InChIKeyLXQZAQRFLHVEPU-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.42
Rot. Bonds3

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

2-(2-methyl-4-morpholin-4-ylphenyl)propanamide (PubChem CID 142676470) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide.

Molecular Properties

Compound Name2-(2-methyl-4-morpholin-4-ylphenyl)propanamide
PubChem CID142676470
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name2-(2-methyl-4-morpholin-4-ylphenyl)propanamide
SMILESCc1cc(N2CCOCC2)ccc1C(C)C(N)=O
InChIInChI=1S/C14H20N2O2/c1-10-9-12(16-5-7-18-8-6-16)3-4-13(10)11(2)14(15)17/h3-4,9,11H,5-8H2,1-2H3,(H2,15,17)
InChIKeyLXQZAQRFLHVEPU-UHFFFAOYSA-N
XLogP1.42
TPSA55.56 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 ≤ 51.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_E(186)', 'substructure': 'N/A'}

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Related Compounds

CID 155667695
CID 155667695
ethyl (2S)-2-(2-methyl-4-morpholin-4-ylanilino)propanoate
CID 141056523
(2R)-2-(2-methyl-4-morpholin-4-ylanilino)-1-morpholin-4-ylpropan-1-one
CID 94114537
methyl 2-methyl-4-morpholin-4-ylbenzoate
CID 90024135
4-[1-[4-(4-butan-2-yl-3-methylphenyl)piperazin-1-yl]ethyl]oxane-4-carboxamide
CID 142825209
4-(4-ethyl-3-methylphenyl)morpholine
CID 71052308
4-morpholin-4-yl-2-propan-2-ylaniline
CID 91671939
methyl 2-hydroxy-2-(4-morpholin-4-ylphenyl)acetate
CID 117380930
methyl 2-hydroxy-2-(2-hydroxy-5-morpholin-4-ylphenyl)acetate
CID 117421323
1-[2-methyl-4-(1,4-oxazepan-4-yl)phenyl]propan-2-amine
CID 55236036
N-[1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethyl]-4-morpholin-4-ylbenzamide
CID 133186522
1-tert-butyl-3-(2-methyl-4-morpholin-4-ylphenyl)urea
CID 78896475

Frequently Asked Questions

What is the IUPAC name of 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The IUPAC name of 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide (CID 142676470) is 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide.
What is the SMILES notation for 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The canonical SMILES for 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide is Cc1cc(N2CCOCC2)ccc1C(C)C(N)=O.
What is the InChIKey of 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
The InChIKey is LXQZAQRFLHVEPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-9-12(16-5-7-18-8-6-16)3-4-13(10)11(2)14(15)17/h3-4,9,11H,5-8H2,1-2H3,(H2,15,17).
What are the key properties of 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide?
2-(2-methyl-4-morpholin-4-ylphenyl)propanamide has a molecular weight of 248.33 g/mol, XLogP of 1.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methyl-4-morpholin-4-ylphenyl)propanamide is sourced from PubChem (CID 142676470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).