N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide

C15H23N3O2 — CID 43544160

IUPACN-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide
SMILESCc1ccc(NC(=O)CN2CC(C)OCC2C)cc1N
InChIInChI=1S/C15H23N3O2/c1-10-4-5-13(6-14(10)16)17-15(19)8-18-7-12(3)20-9-11(18)2/h4-6,11-12H,7-9,16H2,1-3H3,(H,17,19)
InChIKeyISZBJYAOOPMEGD-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.62
Rot. Bonds3

About N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide

N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide (PubChem CID 43544160) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide.

Molecular Properties

Compound NameN-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide
PubChem CID43544160
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide
SMILESCc1ccc(NC(=O)CN2CC(C)OCC2C)cc1N
InChIInChI=1S/C15H23N3O2/c1-10-4-5-13(6-14(10)16)17-15(19)8-18-7-12(3)20-9-11(18)2/h4-6,11-12H,7-9,16H2,1-3H3,(H,17,19)
InChIKeyISZBJYAOOPMEGD-UHFFFAOYSA-N
XLogP1.62
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-aminophenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide
CID 43544225
2-(2,5-dimethylmorpholin-4-yl)-N-(2,6-dimethylphenyl)acetamide
CID 86928374
2-(2,5-dimethylmorpholin-4-yl)-N-(2-methylphenyl)acetamide
CID 134007228
N-(3-amino-4-methylphenyl)-2-(2,4-dimethylpiperidin-1-yl)acetamide
CID 62331925
N-(3-amino-4-methylphenyl)-2-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)acetamide
CID 102882757
2-(2,5-dimethylmorpholin-4-yl)-N-[3-(2-oxopyrrolidin-1-yl)phenyl]acetamide
CID 46596271
2-[[2-(2,5-dimethylmorpholin-4-yl)acetyl]amino]-N-(2,4,6-trimethylphenyl)acetamide
CID 46595457
N-(4-aminophenyl)-2-(5-ethyl-2-methylmorpholin-4-yl)acetamide
CID 43575099
N-(3-amino-4-methylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 43375487
N-(2,5-dimethoxyphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide
CID 46595482
2-amino-N-(3-amino-4-methylphenyl)acetamide
CID 146654157
2-[2-(3-amino-4-methylanilino)-2-oxoethyl]sulfanylacetamide
CID 114231285

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide?
The IUPAC name of N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide (CID 43544160) is N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide.
What is the SMILES notation for N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide?
The canonical SMILES for N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide is Cc1ccc(NC(=O)CN2CC(C)OCC2C)cc1N.
What is the InChIKey of N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide?
The InChIKey is ISZBJYAOOPMEGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-10-4-5-13(6-14(10)16)17-15(19)8-18-7-12(3)20-9-11(18)2/h4-6,11-12H,7-9,16H2,1-3H3,(H,17,19).
What are the key properties of N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide?
N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide has a molecular weight of 277.37 g/mol, XLogP of 1.62, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-4-methylphenyl)-2-(2,5-dimethylmorpholin-4-yl)acetamide is sourced from PubChem (CID 43544160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).