2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide

C14H22N2O3 — CID 115179793

IUPAC2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide
SMILESCOc1cc(C)c(N(C)C(=O)C(N)CO)c(C)c1C
InChIInChI=1S/C14H22N2O3/c1-8-6-12(19-5)9(2)10(3)13(8)16(4)14(18)11(15)7-17/h6,11,17H,7,15H2,1-5H3
InChIKeyWFXNQRCAWLMRIY-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.90
Rot. Bonds4

About 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide

2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide (PubChem CID 115179793) has the molecular formula C14H22N2O3 and a molecular weight of 266.34 g/mol. Its IUPAC name is 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide.

Molecular Properties

Compound Name2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide
PubChem CID115179793
Molecular FormulaC14H22N2O3
Molecular Weight266.34 g/mol
Exact Mass266.16
IUPAC Name2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide
SMILESCOc1cc(C)c(N(C)C(=O)C(N)CO)c(C)c1C
InChIInChI=1S/C14H22N2O3/c1-8-6-12(19-5)9(2)10(3)13(8)16(4)14(18)11(15)7-17/h6,11,17H,7,15H2,1-5H3
InChIKeyWFXNQRCAWLMRIY-UHFFFAOYSA-N
XLogP0.90
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-3-(4-methoxy-N,2,3,6-tetramethylanilino)propan-1-ol
CID 115120488
1-N-(4-methoxy-2,3,6-trimethylphenyl)-1-N-methylpropane-1,2-diamine
CID 115196463
2-cyano-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylacetamide
CID 115173052
2-amino-N-(5-bromo-2-methoxyphenyl)-3-hydroxy-N-methylpropanamide
CID 115179710
2-amino-3-hydroxy-N-(2-methoxy-4-propan-2-ylphenyl)-N-methylpropanamide
CID 115179737
2-amino-N-(3-chloro-4-methoxyphenyl)-3-hydroxy-N-methylpropanamide
CID 115179694
N-ethyl-4-methoxy-N,2,3,6-tetramethylaniline
CID 115259372
5-(4-methoxy-N,2,3,6-tetramethylanilino)pentan-2-one
CID 115236416
methyl 2-amino-2-(4-methoxy-2,3,6-trimethylphenyl)acetate
CID 116856970
2-amino-N-(5-tert-butyl-2-methylphenyl)-3-hydroxy-N-methylpropanamide
CID 115179704
2-amino-2-(2-methoxy-4,5-dimethylphenyl)ethanol
CID 77129776
2-amino-3-hydroxy-N-methyl-N-(4-methylphenyl)propanamide
CID 115179676

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide?
The IUPAC name of 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide (CID 115179793) is 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide.
What is the SMILES notation for 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide?
The canonical SMILES for 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide is COc1cc(C)c(N(C)C(=O)C(N)CO)c(C)c1C.
What is the InChIKey of 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide?
The InChIKey is WFXNQRCAWLMRIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3/c1-8-6-12(19-5)9(2)10(3)13(8)16(4)14(18)11(15)7-17/h6,11,17H,7,15H2,1-5H3.
What are the key properties of 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide?
2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide has a molecular weight of 266.34 g/mol, XLogP of 0.90, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-hydroxy-N-(4-methoxy-2,3,6-trimethylphenyl)-N-methylpropanamide is sourced from PubChem (CID 115179793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).