2-(ethenylamino)oxy-1-naphthalen-2-ylethanol

C14H15NO2 — CID 57038256

IUPAC2-(ethenylamino)oxy-1-naphthalen-2-ylethanol
SMILESC=CNOCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C14H15NO2/c1-2-15-17-10-14(16)13-8-7-11-5-3-4-6-12(11)9-13/h2-9,14-16H,1,10H2
InChIKeyXKQYEDCMHOOXLD-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.54
Rot. Bonds5

About 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol

2-(ethenylamino)oxy-1-naphthalen-2-ylethanol (PubChem CID 57038256) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol.

Molecular Properties

Compound Name2-(ethenylamino)oxy-1-naphthalen-2-ylethanol
PubChem CID57038256
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name2-(ethenylamino)oxy-1-naphthalen-2-ylethanol
SMILESC=CNOCC(O)c1ccc2ccccc2c1
InChIInChI=1S/C14H15NO2/c1-2-15-17-10-14(16)13-8-7-11-5-3-4-6-12(11)9-13/h2-9,14-16H,1,10H2
InChIKeyXKQYEDCMHOOXLD-UHFFFAOYSA-N
XLogP2.54
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(1R)-2-[[(2S)-but-3-en-2-yl]amino]-1-naphthalen-2-ylethanol
CID 124593831
(1S)-2-[[(2R)-but-3-en-2-yl]amino]-1-naphthalen-2-ylethanol
CID 124593834
(1S)-1-naphthalen-2-yl-2-tri(propan-2-yl)silyloxyethanol
CID 10736263
1-naphthalen-2-ylprop-2-en-1-ol
CID 10921194
2-(dimethylamino)-1-naphthalen-2-ylethanol
CID 60981028
1-naphthalen-2-yl-2-phenylethanol
CID 2793947
ethane;1-naphthalen-2-ylpropan-1-ol
CID 143858826
2-(2-but-3-enoxyethylamino)-1-naphthalen-2-ylethanol
CID 106401540
4,4,4-trifluoro-1-naphthalen-2-ylbutan-1-ol
CID 64565521
methyl 3-hydroxy-3-naphthalen-2-ylpropanoate
CID 14361476
methyl (3R)-3-hydroxy-3-naphthalen-2-ylpropanoate
CID 14361475
(1S)-1-naphthalen-2-ylbutane-1,4-diol
CID 163077127

Frequently Asked Questions

What is the IUPAC name of 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol?
The IUPAC name of 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol (CID 57038256) is 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol.
What is the SMILES notation for 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol?
The canonical SMILES for 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol is C=CNOCC(O)c1ccc2ccccc2c1.
What is the InChIKey of 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol?
The InChIKey is XKQYEDCMHOOXLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-2-15-17-10-14(16)13-8-7-11-5-3-4-6-12(11)9-13/h2-9,14-16H,1,10H2.
What are the key properties of 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol?
2-(ethenylamino)oxy-1-naphthalen-2-ylethanol has a molecular weight of 229.28 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethenylamino)oxy-1-naphthalen-2-ylethanol is sourced from PubChem (CID 57038256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).