N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide

C15H16N2O2 — CID 43297837

IUPACN-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide
SMILESCC(NC(=O)c1ccc(O)cc1)c1ccccc1N
InChIInChI=1S/C15H16N2O2/c1-10(13-4-2-3-5-14(13)16)17-15(19)11-6-8-12(18)9-7-11/h2-10,18H,16H2,1H3,(H,17,19)
InChIKeyHOQLCGXSULFEHY-UHFFFAOYSA-N
MW256.31 g/mol
LogP2.47
Rot. Bonds3

About N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide

N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide (PubChem CID 43297837) has the molecular formula C15H16N2O2 and a molecular weight of 256.31 g/mol. Its IUPAC name is N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide.

Molecular Properties

Compound NameN-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide
PubChem CID43297837
Molecular FormulaC15H16N2O2
Molecular Weight256.31 g/mol
Exact Mass256.12
IUPAC NameN-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide
SMILESCC(NC(=O)c1ccc(O)cc1)c1ccccc1N
InChIInChI=1S/C15H16N2O2/c1-10(13-4-2-3-5-14(13)16)17-15(19)11-6-8-12(18)9-7-11/h2-10,18H,16H2,1H3,(H,17,19)
InChIKeyHOQLCGXSULFEHY-UHFFFAOYSA-N
XLogP2.47
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 52.47
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[1-(2-aminophenyl)ethyl]pyridine-3-carboxamide
CID 43297891
N-[1-(2-aminophenyl)ethyl]-2-methylpropanamide
CID 43297755
4-amino-N-[1-(2-iodophenyl)ethyl]benzamide
CID 70495566
N-[1-(2-aminophenyl)ethyl]propanamide
CID 43297760
N-[1-(2-aminophenyl)ethyl]-2,6-dimethylpyridine-3-carboxamide
CID 62829021
N-[1-(2-aminophenyl)ethyl]-2-methylpyrazole-3-carboxamide
CID 62920120
N-[1-(2-aminophenyl)ethyl]-2-hydroxy-4-methoxybenzamide
CID 43297787
3-[(1R)-1-(2-aminophenyl)ethyl]-1,1-dimethylurea
CID 40601139
4-N-[1-(2-methylphenyl)ethyl]benzene-1,4-dicarboxamide
CID 51175514
N-[1-(2-aminophenyl)ethyl]-2,5-dimethylbenzamide
CID 43297799
N-(4-aminobutan-2-yl)-4-hydroxybenzamide
CID 62092757
4-bromo-N-[1-(2-bromophenyl)ethyl]benzamide
CID 55027225

Frequently Asked Questions

What is the IUPAC name of N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide?
The IUPAC name of N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide (CID 43297837) is N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide.
What is the SMILES notation for N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide?
The canonical SMILES for N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide is CC(NC(=O)c1ccc(O)cc1)c1ccccc1N.
What is the InChIKey of N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide?
The InChIKey is HOQLCGXSULFEHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O2/c1-10(13-4-2-3-5-14(13)16)17-15(19)11-6-8-12(18)9-7-11/h2-10,18H,16H2,1H3,(H,17,19).
What are the key properties of N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide?
N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide has a molecular weight of 256.31 g/mol, XLogP of 2.47, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(2-aminophenyl)ethyl]-4-hydroxybenzamide is sourced from PubChem (CID 43297837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).