[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone

C15H15NO2 — CID 154157308

IUPAC[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone
SMILESCC(O)c1ccc(N)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C15H15NO2/c1-10(17)12-7-8-14(16)13(9-12)15(18)11-5-3-2-4-6-11/h2-10,17H,16H2,1H3
InChIKeyHCHCYHZPQLLDKV-UHFFFAOYSA-N
MW241.29 g/mol
LogP2.55
Rot. Bonds3

About [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone

[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone (PubChem CID 154157308) has the molecular formula C15H15NO2 and a molecular weight of 241.29 g/mol. Its IUPAC name is [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone.

Molecular Properties

Compound Name[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone
PubChem CID154157308
Molecular FormulaC15H15NO2
Molecular Weight241.29 g/mol
Exact Mass241.11
IUPAC Name[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone
SMILESCC(O)c1ccc(N)c(C(=O)c2ccccc2)c1
InChIInChI=1S/C15H15NO2/c1-10(17)12-7-8-14(16)13(9-12)15(18)11-5-3-2-4-6-11/h2-10,17H,16H2,1H3
InChIKeyHCHCYHZPQLLDKV-UHFFFAOYSA-N
XLogP2.55
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 52.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anthranil_one_A(38)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

S-[4-(4-amino-3-benzoylphenyl)-3,4-dihydroxybutyl] ethanethioate
CID 171876925
[2,5-di(propan-2-yl)phenyl]-phenylmethanone
CID 165349442
(2-aminophenyl)-phenylmethanone
CID 158207972
[2-amino-5-(3-azido-1,2-dihydroxypropyl)phenyl]-phenylmethanone
CID 170827062
(2-aminophenyl)-phenylmethanone;diphenylmethanone
CID 90112643
2-benzoyl-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 11841462
2-(3-benzoyl-4-chlorophenyl)propanoic acid
CID 135074554
butane-2,3-diol;diphenylmethanone
CID 175235923
(2,4-diamino-3-benzoylphenyl)-phenylmethanone
CID 70481575
2-hydroxy-5-[(1S)-1-hydroxyethyl]benzoic acid
CID 131037950
1-(4-amino-3-chlorophenyl)ethanol
CID 126971129
2-[3-(1-hydroxyethyl)phenyl]-2-oxoacetic acid
CID 117108988

Frequently Asked Questions

What is the IUPAC name of [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone?
The IUPAC name of [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone (CID 154157308) is [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone.
What is the SMILES notation for [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone?
The canonical SMILES for [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone is CC(O)c1ccc(N)c(C(=O)c2ccccc2)c1.
What is the InChIKey of [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone?
The InChIKey is HCHCYHZPQLLDKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO2/c1-10(17)12-7-8-14(16)13(9-12)15(18)11-5-3-2-4-6-11/h2-10,17H,16H2,1H3.
What are the key properties of [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone?
[2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone has a molecular weight of 241.29 g/mol, XLogP of 2.55, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-amino-5-(1-hydroxyethyl)phenyl]-phenylmethanone is sourced from PubChem (CID 154157308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).