2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide

C11H16N2O2 — CID 115179676

IUPAC2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide
SMILESCc1ccc(N(C)C(=O)C(N)CO)cc1
InChIInChI=1S/C11H16N2O2/c1-8-3-5-9(6-4-8)13(2)11(15)10(12)7-14/h3-6,10,14H,7,12H2,1-2H3
InChIKeyMPCDGOZLWMMESQ-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.28
Rot. Bonds3

About 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide

2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide (PubChem CID 115179676) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide
PubChem CID115179676
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide
SMILESCc1ccc(N(C)C(=O)C(N)CO)cc1
InChIInChI=1S/C11H16N2O2/c1-8-3-5-9(6-4-8)13(2)11(15)10(12)7-14/h3-6,10,14H,7,12H2,1-2H3
InChIKeyMPCDGOZLWMMESQ-UHFFFAOYSA-N
XLogP0.28
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-amino-N-(4-tert-butylphenyl)-3-hydroxy-N-methylpropanamide
CID 115179679
2-amino-3-hydroxy-N-methyl-N-(4-methylsulfanylphenyl)propanamide
CID 115179752
2-amino-N-(4-ethylsulfanylphenyl)-3-hydroxy-N-methylpropanamide
CID 115179753
2-amino-3-hydroxy-N-methyl-N-[2-(4-methylphenyl)ethyl]propanamide
CID 115180130
3-chloro-N,2-dimethyl-N-(4-methylphenyl)propanamide
CID 62726677
2-amino-N-(4-hydroxyphenyl)-N-methylbutanamide
CID 107734416
2-amino-N-(3-chloro-4-methoxyphenyl)-3-hydroxy-N-methylpropanamide
CID 115179694
methyl 2-[methyl-(4-methylphenyl)carbamoyl]butanoate
CID 115187857
2-amino-N-(4-fluorophenyl)-N-methyl-2-(4-methylphenyl)acetamide
CID 106151346
2-amino-N-methyl-N-(4-methylphenyl)acetamide
CID 22617441
4-[[(2S)-2-aminobutanoyl]-methylamino]benzoic acid
CID 113442786
2-amino-N-(4-hydroxyphenyl)-N-methylpropanamide
CID 23221170

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide?
The IUPAC name of 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide (CID 115179676) is 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide.
What is the SMILES notation for 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide?
The canonical SMILES for 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide is Cc1ccc(N(C)C(=O)C(N)CO)cc1.
What is the InChIKey of 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide?
The InChIKey is MPCDGOZLWMMESQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-8-3-5-9(6-4-8)13(2)11(15)10(12)7-14/h3-6,10,14H,7,12H2,1-2H3.
What are the key properties of 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide?
2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide has a molecular weight of 208.26 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 115179676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).