2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol

C11H14FNO2 — CID 117301278

IUPAC2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
SMILESNCC(O)c1c(F)ccc2c1OCCC2
InChIInChI=1S/C11H14FNO2/c12-8-4-3-7-2-1-5-15-11(7)10(8)9(14)6-13/h3-4,9,14H,1-2,5-6,13H2
InChIKeyPQOUANKGBYISLL-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.14
Rot. Bonds2

About 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol

2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol (PubChem CID 117301278) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
PubChem CID117301278
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC Name2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol
SMILESNCC(O)c1c(F)ccc2c1OCCC2
InChIInChI=1S/C11H14FNO2/c12-8-4-3-7-2-1-5-15-11(7)10(8)9(14)6-13/h3-4,9,14H,1-2,5-6,13H2
InChIKeyPQOUANKGBYISLL-UHFFFAOYSA-N
XLogP1.14
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanamine
CID 130845713
2-amino-1-(6-fluoro-3,4-dihydro-2H-1,5-benzodioxepin-9-yl)ethanol
CID 117326513
7-fluoro-3,4-dihydro-2H-chromen-8-ol
CID 10630931
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclopropyl]methanamine
CID 117315960
8-bromo-7-fluoro-3,4-dihydro-2H-chromene
CID 155778553
7-fluoro-3,4-dihydro-2H-chromene-8-carboxylic acid
CID 22404817
[1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)cyclohexyl]methanamine
CID 117413291
8-fluoro-3,4-dihydro-2H-chromen-7-ol
CID 101361843
4-amino-4-(6-fluoro-2,3-dihydro-1-benzofuran-7-yl)butanoic acid
CID 117350314
2-amino-1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 102547105
2-amino-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
CID 82241106
2-amino-1-(8-fluoro-7-methoxy-3,4-dihydro-2H-1,5-benzodioxepin-6-yl)ethanol
CID 117395984

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol?
The IUPAC name of 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol (CID 117301278) is 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol.
What is the SMILES notation for 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol?
The canonical SMILES for 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol is NCC(O)c1c(F)ccc2c1OCCC2.
What is the InChIKey of 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol?
The InChIKey is PQOUANKGBYISLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c12-8-4-3-7-2-1-5-15-11(7)10(8)9(14)6-13/h3-4,9,14H,1-2,5-6,13H2.
What are the key properties of 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol?
2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol has a molecular weight of 211.24 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(7-fluoro-3,4-dihydro-2H-chromen-8-yl)ethanol is sourced from PubChem (CID 117301278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).