N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide

C15H23N3O3 — CID 81195909

IUPACN-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide
SMILESCC1COC(CO)CN1C(C)C(=O)Nc1ccc(N)cc1
InChIInChI=1S/C15H23N3O3/c1-10-9-21-14(8-19)7-18(10)11(2)15(20)17-13-5-3-12(16)4-6-13/h3-6,10-11,14,19H,7-9,16H2,1-2H3,(H,17,20)
InChIKeyZMMUWYTVUDIXRT-UHFFFAOYSA-N
MW293.37 g/mol
LogP0.68
Rot. Bonds4

About N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide

N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide (PubChem CID 81195909) has the molecular formula C15H23N3O3 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide
PubChem CID81195909
Molecular FormulaC15H23N3O3
Molecular Weight293.37 g/mol
Exact Mass293.17
IUPAC NameN-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide
SMILESCC1COC(CO)CN1C(C)C(=O)Nc1ccc(N)cc1
InChIInChI=1S/C15H23N3O3/c1-10-9-21-14(8-19)7-18(10)11(2)15(20)17-13-5-3-12(16)4-6-13/h3-6,10-11,14,19H,7-9,16H2,1-2H3,(H,17,20)
InChIKeyZMMUWYTVUDIXRT-UHFFFAOYSA-N
XLogP0.68
TPSA87.82 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-[4-(aminomethyl)phenyl]-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544268
N-(furan-2-ylmethyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide
CID 81219393
N-(4-amino-2-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544196
N-(5-amino-2-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544200
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-methylpropanamide
CID 81216899
N-(4-aminophenyl)-2-(2,5-dimethylpyrrolidin-1-yl)propanamide
CID 63214737
[4-(4-aminophenyl)-5-methylmorpholin-2-yl]methanol
CID 81206068
1-(5-chlorothiophen-2-yl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propan-1-one
CID 81204637
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-ethylpropanamide
CID 81217224
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-cyclohexylpropanamide
CID 81217117
2-[2-(aminomethyl)-5-methylmorpholin-4-yl]-N-(methylcarbamoyl)propanamide
CID 81217822
N-(3-amino-2-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)propanamide
CID 43544182

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide?
The IUPAC name of N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide (CID 81195909) is N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide.
What is the SMILES notation for N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide?
The canonical SMILES for N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide is CC1COC(CO)CN1C(C)C(=O)Nc1ccc(N)cc1.
What is the InChIKey of N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide?
The InChIKey is ZMMUWYTVUDIXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3/c1-10-9-21-14(8-19)7-18(10)11(2)15(20)17-13-5-3-12(16)4-6-13/h3-6,10-11,14,19H,7-9,16H2,1-2H3,(H,17,20).
What are the key properties of N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide?
N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide has a molecular weight of 293.37 g/mol, XLogP of 0.68, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-2-[2-(hydroxymethyl)-5-methylmorpholin-4-yl]propanamide is sourced from PubChem (CID 81195909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).