2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol

C10H10F2N2O — CID 117302615

IUPAC2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol
SMILESNC(CO)c1c(F)cc2cc[nH]c2c1F
InChIInChI=1S/C10H10F2N2O/c11-6-3-5-1-2-14-10(5)9(12)8(6)7(13)4-15/h1-3,7,14-15H,4,13H2
InChIKeyRAYYESRGXJAGCG-UHFFFAOYSA-N
MW212.20 g/mol
LogP1.44
Rot. Bonds2

About 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol

2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol (PubChem CID 117302615) has the molecular formula C10H10F2N2O and a molecular weight of 212.20 g/mol. Its IUPAC name is 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol.

Molecular Properties

Compound Name2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol
PubChem CID117302615
Molecular FormulaC10H10F2N2O
Molecular Weight212.20 g/mol
Exact Mass212.08
IUPAC Name2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol
SMILESNC(CO)c1c(F)cc2cc[nH]c2c1F
InChIInChI=1S/C10H10F2N2O/c11-6-3-5-1-2-14-10(5)9(12)8(6)7(13)4-15/h1-3,7,14-15H,4,13H2
InChIKeyRAYYESRGXJAGCG-UHFFFAOYSA-N
XLogP1.44
TPSA62.04 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.20
LogP ≤ 51.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

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Related Compounds

2-amino-2-(5,7-difluoro-1H-indol-6-yl)acetic acid
CID 117324730
1-(5,7-difluoro-1H-indol-6-yl)ethanol
CID 117286630
3-amino-2-(5,7-difluoro-1H-indol-6-yl)propanoic acid
CID 117352563
1-(5,7-difluoro-1H-indol-6-yl)propan-2-amine
CID 117300028
(2R)-2-amino-2-(2,6-difluoro-4-iodophenyl)ethanol
CID 66515682
2-amino-2-(7-chloro-1H-indol-5-yl)ethanol
CID 83885288
(2R)-2-amino-2-(4-amino-2,6-difluorophenyl)ethanol
CID 66514003
(2S)-2-amino-2-(2,4,6-trifluorophenyl)ethanol;hydrochloride
CID 171204906
5,7-difluoro-1H-indole-6-carboxylic acid
CID 117274550
(2S)-2-amino-2-(2,6-difluoro-3-methylphenyl)ethanol;hydrochloride
CID 171209975
(2S)-2-amino-2-(4-bromo-2,6-difluorophenyl)ethanol;hydrochloride
CID 171206728
(2S)-2-amino-2-(7-fluoro-1H-indol-2-yl)ethanol
CID 96754178

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol?
The IUPAC name of 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol (CID 117302615) is 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol.
What is the SMILES notation for 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol?
The canonical SMILES for 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol is NC(CO)c1c(F)cc2cc[nH]c2c1F.
What is the InChIKey of 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol?
The InChIKey is RAYYESRGXJAGCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F2N2O/c11-6-3-5-1-2-14-10(5)9(12)8(6)7(13)4-15/h1-3,7,14-15H,4,13H2.
What are the key properties of 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol?
2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol has a molecular weight of 212.20 g/mol, XLogP of 1.44, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-(5,7-difluoro-1H-indol-6-yl)ethanol is sourced from PubChem (CID 117302615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).