2-amino-1-(3-hydroxyphenyl)ethanone

C8H9NO2 — CID 3021590

IUPAC2-amino-1-(3-hydroxyphenyl)ethanone
SMILESNCC(=O)c1cccc(O)c1
InChIInChI=1S/C8H9NO2/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,10H,5,9H2
InChIKeySCHLZTPPFPHHPY-UHFFFAOYSA-N
MW151.16 g/mol
LogP0.53
Rot. Bonds2

About 2-amino-1-(3-hydroxyphenyl)ethanone

2-amino-1-(3-hydroxyphenyl)ethanone (PubChem CID 3021590) has the molecular formula C8H9NO2 and a molecular weight of 151.16 g/mol. Its IUPAC name is 2-amino-1-(3-hydroxyphenyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(3-hydroxyphenyl)ethanone
PubChem CID3021590
Molecular FormulaC8H9NO2
Molecular Weight151.16 g/mol
Exact Mass151.06
IUPAC Name2-amino-1-(3-hydroxyphenyl)ethanone
SMILESNCC(=O)c1cccc(O)c1
InChIInChI=1S/C8H9NO2/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,10H,5,9H2
InChIKeySCHLZTPPFPHHPY-UHFFFAOYSA-N
XLogP0.53
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 ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3-hydroxyphenyl)ethanone?
The IUPAC name of 2-amino-1-(3-hydroxyphenyl)ethanone (CID 3021590) is 2-amino-1-(3-hydroxyphenyl)ethanone.
What is the SMILES notation for 2-amino-1-(3-hydroxyphenyl)ethanone?
The canonical SMILES for 2-amino-1-(3-hydroxyphenyl)ethanone is NCC(=O)c1cccc(O)c1.
What is the InChIKey of 2-amino-1-(3-hydroxyphenyl)ethanone?
The InChIKey is SCHLZTPPFPHHPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9NO2/c9-5-8(11)6-2-1-3-7(10)4-6/h1-4,10H,5,9H2.
What are the key properties of 2-amino-1-(3-hydroxyphenyl)ethanone?
2-amino-1-(3-hydroxyphenyl)ethanone has a molecular weight of 151.16 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3-hydroxyphenyl)ethanone is sourced from PubChem (CID 3021590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).