2-amino-7-ethyl-1-benzothiophen-4-ol

C10H11NOS — CID 130971743

IUPAC2-amino-7-ethyl-1-benzothiophen-4-ol
SMILESCCc1ccc(O)c2cc(N)sc12
InChIInChI=1S/C10H11NOS/c1-2-6-3-4-8(12)7-5-9(11)13-10(6)7/h3-5,12H,2,11H2,1H3
InChIKeyAHEFIEOGCFRRJF-UHFFFAOYSA-N
MW193.27 g/mol
LogP2.75
Rot. Bonds1

About 2-amino-7-ethyl-1-benzothiophen-4-ol

2-amino-7-ethyl-1-benzothiophen-4-ol (PubChem CID 130971743) has the molecular formula C10H11NOS and a molecular weight of 193.27 g/mol. Its IUPAC name is 2-amino-7-ethyl-1-benzothiophen-4-ol.

Molecular Properties

Compound Name2-amino-7-ethyl-1-benzothiophen-4-ol
PubChem CID130971743
Molecular FormulaC10H11NOS
Molecular Weight193.27 g/mol
Exact Mass193.06
IUPAC Name2-amino-7-ethyl-1-benzothiophen-4-ol
SMILESCCc1ccc(O)c2cc(N)sc12
InChIInChI=1S/C10H11NOS/c1-2-6-3-4-8(12)7-5-9(11)13-10(6)7/h3-5,12H,2,11H2,1H3
InChIKeyAHEFIEOGCFRRJF-UHFFFAOYSA-N
XLogP2.75
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.27
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(7-ethyl-2-fluoro-1-benzothiophen-4-yl)methanol
CID 131097075
lithium;butane;6-ethyldibenzothiophen-4-ol
CID 87765195
3-amino-4-ethylphenol;hydrochloride
CID 178200309
4,7-dimethyl-1-benzothiophen-2-amine
CID 131095149
4-(bromomethyl)-7-ethyl-2-iodo-1-benzothiophene
CID 130956704
7-ethyl-2-iodo-1-benzothiophen-3-ol
CID 130825583
thieno[3,2-e][1]benzothiole-2,7-diamine
CID 69036958
4,7-dihydroxy-1-benzothiophene-2-sulfonamide
CID 21283475
4-ethylbenzene-1,3-diol
CID 17927
5-amino-3-ethylthiophene-2-carbaldehyde
CID 96589959
7-aminothieno[3,2-e][1]benzothiol-2-ol
CID 69035510
5-(bromomethyl)-7-ethyl-1-benzothiophen-2-amine
CID 131169442

Frequently Asked Questions

What is the IUPAC name of 2-amino-7-ethyl-1-benzothiophen-4-ol?
The IUPAC name of 2-amino-7-ethyl-1-benzothiophen-4-ol (CID 130971743) is 2-amino-7-ethyl-1-benzothiophen-4-ol.
What is the SMILES notation for 2-amino-7-ethyl-1-benzothiophen-4-ol?
The canonical SMILES for 2-amino-7-ethyl-1-benzothiophen-4-ol is CCc1ccc(O)c2cc(N)sc12.
What is the InChIKey of 2-amino-7-ethyl-1-benzothiophen-4-ol?
The InChIKey is AHEFIEOGCFRRJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NOS/c1-2-6-3-4-8(12)7-5-9(11)13-10(6)7/h3-5,12H,2,11H2,1H3.
What are the key properties of 2-amino-7-ethyl-1-benzothiophen-4-ol?
2-amino-7-ethyl-1-benzothiophen-4-ol has a molecular weight of 193.27 g/mol, XLogP of 2.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-7-ethyl-1-benzothiophen-4-ol is sourced from PubChem (CID 130971743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).