2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol

C11H15NO2 — CID 82241106

IUPAC2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
SMILESNCC(O)c1ccc2c(c1)CCCO2
InChIInChI=1S/C11H15NO2/c12-7-10(13)8-3-4-11-9(6-8)2-1-5-14-11/h3-4,6,10,13H,1-2,5,7,12H2
InChIKeyMBIHLTNWHOEKRC-UHFFFAOYSA-N
MW193.25 g/mol
LogP1.00
Rot. Bonds2

About 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol

2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol (PubChem CID 82241106) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
PubChem CID82241106
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC Name2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
SMILESNCC(O)c1ccc2c(c1)CCCO2
InChIInChI=1S/C11H15NO2/c12-7-10(13)8-3-4-11-9(6-8)2-1-5-14-11/h3-4,6,10,13H,1-2,5,7,12H2
InChIKeyMBIHLTNWHOEKRC-UHFFFAOYSA-N
XLogP1.00
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-1-(2,3,4,5-tetrahydro-1-benzoxepin-7-yl)ethanol
CID 82241510
1,3-diamino-1-(3,4-dihydro-2H-chromen-6-yl)propan-2-ol
CID 116942558
2-amino-1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethanol
CID 60869534
2-(4-chlorophenyl)-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
CID 61080781
1-(3,4-dihydro-2H-chromen-6-yl)octan-1-ol
CID 55199817
(1R)-2-amino-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanol
CID 7300390
3,4-dihydro-2H-chromen-6-yl-(4-propan-2-ylphenyl)methanol
CID 61083091
3-cyclohexyl-1-(3,4-dihydro-2H-chromen-6-yl)propan-1-ol
CID 63427036
1-(3,4-dihydro-2H-chromen-6-yl)-2-(3,4-dimethylphenyl)ethanol
CID 62538318
(1S)-2-amino-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 83001263
2-amino-1-(3,4-dihydro-2H-chromen-6-yl)-2-methylpropan-1-ol
CID 82242253
2-amino-1-(2,2-dimethyl-4,5-dihydro-3H-1-benzoxepin-7-yl)ethanol
CID 117097087

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol?
The IUPAC name of 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol (CID 82241106) is 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol.
What is the SMILES notation for 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol?
The canonical SMILES for 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol is NCC(O)c1ccc2c(c1)CCCO2.
What is the InChIKey of 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol?
The InChIKey is MBIHLTNWHOEKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c12-7-10(13)8-3-4-11-9(6-8)2-1-5-14-11/h3-4,6,10,13H,1-2,5,7,12H2.
What are the key properties of 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol?
2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol has a molecular weight of 193.25 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol is sourced from PubChem (CID 82241106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).