2-anilino-1-(oxolan-3-yl)ethanol

C12H17NO2 — CID 82239516

IUPAC2-anilino-1-(oxolan-3-yl)ethanol
SMILESOC(CNc1ccccc1)C1CCOC1
InChIInChI=1S/C12H17NO2/c14-12(10-6-7-15-9-10)8-13-11-4-2-1-3-5-11/h1-5,10,12-14H,6-9H2
InChIKeyAIZYHNNKAAFMOZ-UHFFFAOYSA-N
MW207.27 g/mol
LogP1.50
Rot. Bonds4

About 2-anilino-1-(oxolan-3-yl)ethanol

2-anilino-1-(oxolan-3-yl)ethanol (PubChem CID 82239516) has the molecular formula C12H17NO2 and a molecular weight of 207.27 g/mol. Its IUPAC name is 2-anilino-1-(oxolan-3-yl)ethanol.

Molecular Properties

Compound Name2-anilino-1-(oxolan-3-yl)ethanol
PubChem CID82239516
Molecular FormulaC12H17NO2
Molecular Weight207.27 g/mol
Exact Mass207.13
IUPAC Name2-anilino-1-(oxolan-3-yl)ethanol
SMILESOC(CNc1ccccc1)C1CCOC1
InChIInChI=1S/C12H17NO2/c14-12(10-6-7-15-9-10)8-13-11-4-2-1-3-5-11/h1-5,10,12-14H,6-9H2
InChIKeyAIZYHNNKAAFMOZ-UHFFFAOYSA-N
XLogP1.50
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.27
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-anilino-1-(oxolan-3-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(oxolan-3-yl)-3-phenoxypropan-1-ol
CID 63565308
N-[1-(oxolan-3-yl)propyl]aniline
CID 115729358
1-(oxolan-3-yl)-2-pyridin-2-ylethanol
CID 63562842
2-[1-(oxolan-3-yl)ethylamino]-N-phenylacetamide
CID 115713791
N-[2-(oxan-4-yloxy)propyl]aniline
CID 62584422
N-(oxolan-3-yl)-N'-phenylethane-1,2-diamine
CID 115693261
1-(oxan-4-yl)-2-phenoxyethanol
CID 63936275
2-[(2-ethylquinolin-4-yl)amino]-1-(oxan-4-yl)ethanol
CID 133402118
(1S)-2-amino-1-[(3R)-oxolan-3-yl]ethanol
CID 93046962
(1S)-2-bromo-1-[(3S)-oxolan-3-yl]ethanol
CID 124679633
1-(oxolan-3-yl)-2-[2-(trifluoromethyl)phenoxy]ethanol
CID 104753430
2-(2,3-dihydroindol-1-yl)-1-(oxolan-3-yl)ethanol
CID 113449076

Frequently Asked Questions

What is the IUPAC name of 2-anilino-1-(oxolan-3-yl)ethanol?
The IUPAC name of 2-anilino-1-(oxolan-3-yl)ethanol (CID 82239516) is 2-anilino-1-(oxolan-3-yl)ethanol.
What is the SMILES notation for 2-anilino-1-(oxolan-3-yl)ethanol?
The canonical SMILES for 2-anilino-1-(oxolan-3-yl)ethanol is OC(CNc1ccccc1)C1CCOC1.
What is the InChIKey of 2-anilino-1-(oxolan-3-yl)ethanol?
The InChIKey is AIZYHNNKAAFMOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17NO2/c14-12(10-6-7-15-9-10)8-13-11-4-2-1-3-5-11/h1-5,10,12-14H,6-9H2.
What are the key properties of 2-anilino-1-(oxolan-3-yl)ethanol?
2-anilino-1-(oxolan-3-yl)ethanol has a molecular weight of 207.27 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-1-(oxolan-3-yl)ethanol is sourced from PubChem (CID 82239516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).