2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide

C16H18N2O3 — CID 63654675

IUPAC2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide
SMILESNC(=O)C(N)(COc1ccccc1CO)c1ccccc1
InChIInChI=1S/C16H18N2O3/c17-15(20)16(18,13-7-2-1-3-8-13)11-21-14-9-5-4-6-12(14)10-19/h1-9,19H,10-11,18H2,(H2,17,20)
InChIKeyFFHOARWFUOPGMC-UHFFFAOYSA-N
MW286.33 g/mol
LogP0.90
Rot. Bonds6

About 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide

2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide (PubChem CID 63654675) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide.

Molecular Properties

Compound Name2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide
PubChem CID63654675
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide
SMILESNC(=O)C(N)(COc1ccccc1CO)c1ccccc1
InChIInChI=1S/C16H18N2O3/c17-15(20)16(18,13-7-2-1-3-8-13)11-21-14-9-5-4-6-12(14)10-19/h1-9,19H,10-11,18H2,(H2,17,20)
InChIKeyFFHOARWFUOPGMC-UHFFFAOYSA-N
XLogP0.90
TPSA98.57 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 50.90
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-4-[2-(hydroxymethyl)phenoxy]-2-phenylbutan-1-ol
CID 116695402
(E)-4-[2-(hydroxymethyl)phenoxy]but-2-enoic acid
CID 63653773
2-amino-6-[[2-(hydroxymethyl)phenoxy]methyl]benzoic acid
CID 104825495
[2-(2-phenylprop-2-enoxy)phenyl]methanol
CID 70376381
N'-hydroxy-2-[2-(hydroxymethyl)phenoxy]ethanimidamide
CID 77003791
2-amino-3-[3-(2-methoxyethoxy)propoxy]-2-phenylpropanamide
CID 103404950
1-[2-(hydroxymethyl)phenoxy]-3-methoxypropan-2-one
CID 107508156
1-[2-(hydroxymethyl)phenoxy]-2-methylbutan-2-ol
CID 114494372
2-amino-3-pentan-2-yloxy-2-phenylpropanamide
CID 102984296
2-amino-2-cyclopropyl-3-[2-(hydroxymethyl)phenoxy]propanenitrile
CID 63906534
2-[2-(hydroxymethyl)-6-methoxyphenoxy]acetamide
CID 964386
4-[[2-(hydroxymethyl)phenoxy]methyl]benzamide
CID 103616898

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide?
The IUPAC name of 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide (CID 63654675) is 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide.
What is the SMILES notation for 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide?
The canonical SMILES for 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide is NC(=O)C(N)(COc1ccccc1CO)c1ccccc1.
What is the InChIKey of 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide?
The InChIKey is FFHOARWFUOPGMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c17-15(20)16(18,13-7-2-1-3-8-13)11-21-14-9-5-4-6-12(14)10-19/h1-9,19H,10-11,18H2,(H2,17,20).
What are the key properties of 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide?
2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide has a molecular weight of 286.33 g/mol, XLogP of 0.90, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-[2-(hydroxymethyl)phenoxy]-2-phenylpropanamide is sourced from PubChem (CID 63654675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).