N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide

C16H18N2O3 — CID 80743477

IUPACN-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide
SMILESNc1ccc(C(O)CNC(=O)Cc2ccccc2O)cc1
InChIInChI=1S/C16H18N2O3/c17-13-7-5-11(6-8-13)15(20)10-18-16(21)9-12-3-1-2-4-14(12)19/h1-8,15,19-20H,9-10,17H2,(H,18,21)
InChIKeyHDDNWKPMUWZKJW-UHFFFAOYSA-N
MW286.33 g/mol
LogP1.37
Rot. Bonds5

About N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide

N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide (PubChem CID 80743477) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide
PubChem CID80743477
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide
SMILESNc1ccc(C(O)CNC(=O)Cc2ccccc2O)cc1
InChIInChI=1S/C16H18N2O3/c17-13-7-5-11(6-8-13)15(20)10-18-16(21)9-12-3-1-2-4-14(12)19/h1-8,15,19-20H,9-10,17H2,(H,18,21)
InChIKeyHDDNWKPMUWZKJW-UHFFFAOYSA-N
XLogP1.37
TPSA95.58 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 51.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-(2-aminophenyl)-N-(2-hydroxy-2-phenylethyl)acetamide
CID 43498529
2-(2-hydroxyphenyl)-N-(2-methylpropyl)acetamide
CID 22947307
N-[2-(4-aminophenyl)-2-hydroxyethyl]acetamide
CID 43461402
3-(4-aminophenyl)-N-(2-hydroxy-2-phenylethyl)propanamide
CID 61036910
N-(4-hydroxy-2-methylpentyl)-2-(2-hydroxyphenyl)acetamide
CID 71980512
N-[2-(4-aminophenyl)-2-hydroxyethyl]-5-chloro-2-hydroxybenzamide
CID 43461425
N-[2-(4-aminophenyl)-2-hydroxyethyl]-2,2,2-trifluoroacetamide
CID 107335113
2-(2-hydroxyphenyl)-N-[2-(methylamino)propyl]acetamide
CID 103512690
methyl 2-chloro-3-[[2-(2-hydroxyphenyl)acetyl]amino]propanoate
CID 103492759
2-(2-chlorophenyl)-N-[2-hydroxy-2-(4-methylsulfanylphenyl)ethyl]acetamide
CID 90581804
2-(2-chlorophenyl)-N-[(2S)-2-[4-(dimethylamino)phenyl]-2-hydroxyethyl]acetamide
CID 97105924
3-amino-N-(2-hydroxy-2-phenylethyl)propanamide
CID 43500072

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide?
The IUPAC name of N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide (CID 80743477) is N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide.
What is the SMILES notation for N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide?
The canonical SMILES for N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide is Nc1ccc(C(O)CNC(=O)Cc2ccccc2O)cc1.
What is the InChIKey of N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide?
The InChIKey is HDDNWKPMUWZKJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c17-13-7-5-11(6-8-13)15(20)10-18-16(21)9-12-3-1-2-4-14(12)19/h1-8,15,19-20H,9-10,17H2,(H,18,21).
What are the key properties of N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide?
N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide has a molecular weight of 286.33 g/mol, XLogP of 1.37, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-aminophenyl)-2-hydroxyethyl]-2-(2-hydroxyphenyl)acetamide is sourced from PubChem (CID 80743477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).