2-amino-1-(5-methoxythiophen-2-yl)ethanol

C7H11NO2S — CID 130587547

IUPAC2-amino-1-(5-methoxythiophen-2-yl)ethanol
SMILESCOc1ccc(C(O)CN)s1
InChIInChI=1S/C7H11NO2S/c1-10-7-3-2-6(11-7)5(9)4-8/h2-3,5,9H,4,8H2,1H3
InChIKeyDUFQZQZALUFKCS-UHFFFAOYSA-N
MW173.24 g/mol
LogP0.75
Rot. Bonds3

About 2-amino-1-(5-methoxythiophen-2-yl)ethanol

2-amino-1-(5-methoxythiophen-2-yl)ethanol (PubChem CID 130587547) has the molecular formula C7H11NO2S and a molecular weight of 173.24 g/mol. Its IUPAC name is 2-amino-1-(5-methoxythiophen-2-yl)ethanol.

Molecular Properties

Compound Name2-amino-1-(5-methoxythiophen-2-yl)ethanol
PubChem CID130587547
Molecular FormulaC7H11NO2S
Molecular Weight173.24 g/mol
Exact Mass173.05
IUPAC Name2-amino-1-(5-methoxythiophen-2-yl)ethanol
SMILESCOc1ccc(C(O)CN)s1
InChIInChI=1S/C7H11NO2S/c1-10-7-3-2-6(11-7)5(9)4-8/h2-3,5,9H,4,8H2,1H3
InChIKeyDUFQZQZALUFKCS-UHFFFAOYSA-N
XLogP0.75
TPSA55.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.24
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(5-methoxythiophen-2-yl)butan-2-ol
CID 130587877
2-(3-chlorobutan-2-yl)-5-methoxythiophene
CID 130587886
2-amino-1-[5-(2-methylphenyl)thiophen-2-yl]ethanol
CID 82116281
cyclobutyl-(5-methoxythiophen-2-yl)methanamine
CID 130587724
(1R)-N-[(5-methoxythiophen-2-yl)methyl]-1-(5-methylthiophen-2-yl)ethanamine
CID 97228607
2-amino-1-(2-methoxyphenyl)ethanol;hydrochloride
CID 54593518
1-[5-(aminomethyl)thiophen-2-yl]propan-1-ol
CID 82375071
2-[bromo(cyclopentyl)methyl]-5-methoxythiophene
CID 130588210
2-amino-1-[5-(3-chlorophenyl)thiophen-2-yl]ethanol
CID 82120008
(1R)-2-amino-1-(2,4,5-trimethoxyphenyl)ethanol
CID 28743465
2-ethyl-5-methoxythiophene
CID 59502951
2-chloro-5-[chloro-(5-methoxythiophen-2-yl)methyl]furan
CID 130588150

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(5-methoxythiophen-2-yl)ethanol?
The IUPAC name of 2-amino-1-(5-methoxythiophen-2-yl)ethanol (CID 130587547) is 2-amino-1-(5-methoxythiophen-2-yl)ethanol.
What is the SMILES notation for 2-amino-1-(5-methoxythiophen-2-yl)ethanol?
The canonical SMILES for 2-amino-1-(5-methoxythiophen-2-yl)ethanol is COc1ccc(C(O)CN)s1.
What is the InChIKey of 2-amino-1-(5-methoxythiophen-2-yl)ethanol?
The InChIKey is DUFQZQZALUFKCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO2S/c1-10-7-3-2-6(11-7)5(9)4-8/h2-3,5,9H,4,8H2,1H3.
What are the key properties of 2-amino-1-(5-methoxythiophen-2-yl)ethanol?
2-amino-1-(5-methoxythiophen-2-yl)ethanol has a molecular weight of 173.24 g/mol, XLogP of 0.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(5-methoxythiophen-2-yl)ethanol is sourced from PubChem (CID 130587547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).