1-(4-aminophenyl)-2-hydroxyethanone

C8H9NO2 — CID 19755805

IUPAC1-(4-aminophenyl)-2-hydroxyethanone
SMILESNc1ccc(C(=O)CO)cc1
InChIInChI=1S/C8H9NO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,10H,5,9H2
InChIKeyODFJHJRVYQMFCT-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.44
Rot. Bonds2

About 1-(4-aminophenyl)-2-hydroxyethanone

1-(4-aminophenyl)-2-hydroxyethanone (PubChem CID 19755805) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 1-(4-aminophenyl)-2-hydroxyethanone.

Molecular Properties

Compound Name1-(4-aminophenyl)-2-hydroxyethanone
PubChem CID19755805
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name1-(4-aminophenyl)-2-hydroxyethanone
SMILESNc1ccc(C(=O)CO)cc1
InChIInChI=1S/C8H9NO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,10H,5,9H2
InChIKeyODFJHJRVYQMFCT-UHFFFAOYSA-N
XLogP0.44
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.16
LogP ≤ 50.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(4-aminophenyl)propan-1-one
CID 6270
1-(4-aminophenyl)-2-sulfanylethanone
CID 89175546
1-(4-aminophenyl)-4-hydroxybutan-1-one
CID 53407117
4-(2-hydroxyacetyl)benzoyl chloride
CID 89280551
1-[4-(2-fluoroacetyl)phenyl]-2-hydroxyethanone
CID 58149469
azane;2-hydroxy-1-phenylethanone
CID 161228887
1-(4-aminophenyl)-2-(dimethylamino)ethanone;hydrochloride
CID 170896135
1-(4-aminophenyl)-2-[5-[2-(4-aminophenyl)-2-oxoethyl]-2,4-dihydroxyphenyl]ethanone
CID 158513452
4-aminobenzenecarbothioic S-acid
CID 18539755
4-aminobenzoic acid;hydrofluoride
CID 159690577
bis(1-(4-aminophenyl)ethanone);yttrium
CID 58212341
phenacyl 4-aminobenzoate
CID 781350

Frequently Asked Questions

What is the IUPAC name of 1-(4-aminophenyl)-2-hydroxyethanone?
The IUPAC name of 1-(4-aminophenyl)-2-hydroxyethanone (CID 19755805) is 1-(4-aminophenyl)-2-hydroxyethanone.
What is the SMILES notation for 1-(4-aminophenyl)-2-hydroxyethanone?
The canonical SMILES for 1-(4-aminophenyl)-2-hydroxyethanone is Nc1ccc(C(=O)CO)cc1.
What is the InChIKey of 1-(4-aminophenyl)-2-hydroxyethanone?
The InChIKey is ODFJHJRVYQMFCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c9-7-3-1-6(2-4-7)8(11)5-10/h1-4,10H,5,9H2.
What are the key properties of 1-(4-aminophenyl)-2-hydroxyethanone?
1-(4-aminophenyl)-2-hydroxyethanone has a molecular weight of 151.16 g/mol, XLogP of 0.44, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-aminophenyl)-2-hydroxyethanone is sourced from PubChem (CID 19755805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).