azane;2-hydroxy-1-phenylethanone

C8H11NO2 — CID 161228887

IUPACazane;2-hydroxy-1-phenylethanone
SMILESN.O=C(CO)c1ccccc1
InChIInChI=1S/C8H8O2.H3N/c9-6-8(10)7-4-2-1-3-5-7;/h1-5,9H,6H2;1H3
InChIKeyUYMICZQBUOROQW-UHFFFAOYSA-N
MW153.18 g/mol
LogP1.02
Rot. Bonds2

About azane;2-hydroxy-1-phenylethanone

azane;2-hydroxy-1-phenylethanone (PubChem CID 161228887) has the molecular formula C8H11NO2 and a molecular weight of 153.18 g/mol. Its IUPAC name is azane;2-hydroxy-1-phenylethanone.

Molecular Properties

Compound Nameazane;2-hydroxy-1-phenylethanone
PubChem CID161228887
Molecular FormulaC8H11NO2
Molecular Weight153.18 g/mol
Exact Mass153.08
IUPAC Nameazane;2-hydroxy-1-phenylethanone
SMILESN.O=C(CO)c1ccccc1
InChIInChI=1S/C8H8O2.H3N/c9-6-8(10)7-4-2-1-3-5-7;/h1-5,9H,6H2;1H3
InChIKeyUYMICZQBUOROQW-UHFFFAOYSA-N
XLogP1.02
TPSA72.30 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

benzene;2-hydroxy-1-phenylethanone
CID 174663024
butanoic acid;2-hydroxy-1-phenylethanone
CID 175969128
2-hydroxy-1-phenylethanone;2-methylpropane-1,2-diamine
CID 159852877
1,3-diphenylpropane-1,3-dione;dihydrofluoride
CID 159485423
bis(1,3-diphenylpropane-1,3-dione);zinc
CID 67929938
1-[4-benzoyl-3,5-bis(2-hydroxyacetyl)phenyl]-2-hydroxyethanone
CID 174566620
1-(4-benzoyliodanuidylsulfanylphenyl)-2-hydroxyethanone
CID 163744070
1-phenyl(111C)propan-1-one
CID 11159350
CID 173152165
CID 173152165
tetrakis(2,4-dioxo-4-phenylbutanoic acid);zirconium(4+)
CID 175883253
3-hydroxy-2-(hydroxymethyl)-3-phenylprop-2-enoic acid
CID 67077320
ethane;3-hydroxy-1-phenylpropan-1-one
CID 90864393

Frequently Asked Questions

What is the IUPAC name of azane;2-hydroxy-1-phenylethanone?
The IUPAC name of azane;2-hydroxy-1-phenylethanone (CID 161228887) is azane;2-hydroxy-1-phenylethanone.
What is the SMILES notation for azane;2-hydroxy-1-phenylethanone?
The canonical SMILES for azane;2-hydroxy-1-phenylethanone is N.O=C(CO)c1ccccc1.
What is the InChIKey of azane;2-hydroxy-1-phenylethanone?
The InChIKey is UYMICZQBUOROQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8O2.H3N/c9-6-8(10)7-4-2-1-3-5-7;/h1-5,9H,6H2;1H3.
What are the key properties of azane;2-hydroxy-1-phenylethanone?
azane;2-hydroxy-1-phenylethanone has a molecular weight of 153.18 g/mol, XLogP of 1.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-hydroxy-1-phenylethanone is sourced from PubChem (CID 161228887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).