2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol

C11H15NO2 — CID 155711300

IUPAC2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol
SMILESOCCN[C@@H]1COc2ccccc2C1
InChIInChI=1S/C11H15NO2/c13-6-5-12-10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,12-13H,5-8H2/t10-/m0/s1
InChIKeyWLCVSUPZJBHOBN-JTQLQIEISA-N
MW193.25 g/mol
LogP0.57
Rot. Bonds3

About 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol

2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol (PubChem CID 155711300) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol
PubChem CID155711300
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol
SMILESOCCN[C@@H]1COc2ccccc2C1
InChIInChI=1S/C11H15NO2/c13-6-5-12-10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,12-13H,5-8H2/t10-/m0/s1
InChIKeyWLCVSUPZJBHOBN-JTQLQIEISA-N
XLogP0.57
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]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

(3R)-N-(2,2-dimethylpropyl)-3,4-dihydro-2H-chromen-3-amine
CID 25308320
N-(2,2-dimethylpropyl)-3,4-dihydro-2H-chromen-3-amine
CID 45221354
N-fluoro-3,4-dihydro-2H-chromen-3-amine
CID 141437976
N-(2-methylbutyl)-3,4-dihydro-2H-chromen-3-amine
CID 115887352
3-(2,3-dihydro-1H-inden-2-ylamino)propan-1-ol
CID 3030975
N-[(3R)-3,4-dihydro-2H-chromen-3-yl]benzamide
CID 93499192
2-(2,3-dihydro-1,4-benzodioxin-3-ylamino)ethanol
CID 70091861
N-ethoxy-3,4-dihydro-2H-chromen-3-amine
CID 126985805
N-[(3-chlorophenyl)methyl]-3,4-dihydro-2H-chromen-3-amine
CID 45244633
1-(3,4-dihydro-2H-chromen-3-yl)-3-propylurea
CID 46357538
N-[(5-methylpyrazolidin-3-yl)methyl]-3,4-dihydro-2H-chromen-3-amine
CID 74567618
4-chloro-N-(3,4-dihydro-2H-chromen-3-yl)benzamide
CID 110751510

Frequently Asked Questions

What is the IUPAC name of 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol?
The IUPAC name of 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol (CID 155711300) is 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol.
What is the SMILES notation for 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol?
The canonical SMILES for 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol is OCCN[C@@H]1COc2ccccc2C1.
What is the InChIKey of 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol?
The InChIKey is WLCVSUPZJBHOBN-JTQLQIEISA-N. The full InChI is InChI=1S/C11H15NO2/c13-6-5-12-10-7-9-3-1-2-4-11(9)14-8-10/h1-4,10,12-13H,5-8H2/t10-/m0/s1.
What are the key properties of 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol?
2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol has a molecular weight of 193.25 g/mol, XLogP of 0.57, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(3S)-3,4-dihydro-2H-chromen-3-yl]amino]ethanol is sourced from PubChem (CID 155711300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).