N-(6-hydroxy-1-benzothiophen-2-yl)acetamide

C10H9NO2S — CID 157022042

IUPACN-(6-hydroxy-1-benzothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc2ccc(O)cc2s1
InChIInChI=1S/C10H9NO2S/c1-6(12)11-10-4-7-2-3-8(13)5-9(7)14-10/h2-5,13H,1H3,(H,11,12)
InChIKeyPVVURZCENXWGAR-UHFFFAOYSA-N
MW207.25 g/mol
LogP2.57
Rot. Bonds1

About N-(6-hydroxy-1-benzothiophen-2-yl)acetamide

N-(6-hydroxy-1-benzothiophen-2-yl)acetamide (PubChem CID 157022042) has the molecular formula C10H9NO2S and a molecular weight of 207.25 g/mol. Its IUPAC name is N-(6-hydroxy-1-benzothiophen-2-yl)acetamide.

Molecular Properties

Compound NameN-(6-hydroxy-1-benzothiophen-2-yl)acetamide
PubChem CID157022042
Molecular FormulaC10H9NO2S
Molecular Weight207.25 g/mol
Exact Mass207.04
IUPAC NameN-(6-hydroxy-1-benzothiophen-2-yl)acetamide
SMILESCC(=O)Nc1cc2ccc(O)cc2s1
InChIInChI=1S/C10H9NO2S/c1-6(12)11-10-4-7-2-3-8(13)5-9(7)14-10/h2-5,13H,1H3,(H,11,12)
InChIKeyPVVURZCENXWGAR-UHFFFAOYSA-N
XLogP2.57
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.25
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-Dimethylamino-1-benzothiophen-6-ol
CID 129747926
2-Acetamido-3-hydroxy-5-phenylthiophene
CID 129785091
6-Hydroxy-2-[(2-methylcyclopropanecarbonyl)amino]-1-benzothiophene-3-carboxamide
CID 11266261
Ethyl 6-hydroxybenzothiophene-3-carbamate
CID 15381204
N-(3-hydroxy-1-benzothiophen-2-yl)acetamide
CID 20624334
(2-Ethyl-6-hydroxy-1-benzothiophen-3-yl)carbamic acid
CID 21838731
(6-Hydroxy-1-benzothiophen-3-yl)carbamic acid
CID 21838734
3-(4-Hydroxyphenyl)-4-hydroxy-7H-thieno[2,3-b]pyridin-6-one
CID 54689891
N-(3-hydroxy-1-benzothiophen-5-yl)acetamide
CID 57033614
tert-butyl N-(6-methoxy-1-benzothiophen-2-yl)carbamate
CID 57920371
N-[1-(6-hydroxy-1-benzothiophen-2-yl)ethyl]acetamide
CID 58047144
2-[4-(N-Monomethylamino)phenyl]-6-hydroxybenzothiophene
CID 58160298

Frequently Asked Questions

What is the IUPAC name of N-(6-hydroxy-1-benzothiophen-2-yl)acetamide?
The IUPAC name of N-(6-hydroxy-1-benzothiophen-2-yl)acetamide (CID 157022042) is N-(6-hydroxy-1-benzothiophen-2-yl)acetamide.
What is the SMILES notation for N-(6-hydroxy-1-benzothiophen-2-yl)acetamide?
The canonical SMILES for N-(6-hydroxy-1-benzothiophen-2-yl)acetamide is CC(=O)Nc1cc2ccc(O)cc2s1.
What is the InChIKey of N-(6-hydroxy-1-benzothiophen-2-yl)acetamide?
The InChIKey is PVVURZCENXWGAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO2S/c1-6(12)11-10-4-7-2-3-8(13)5-9(7)14-10/h2-5,13H,1H3,(H,11,12).
What are the key properties of N-(6-hydroxy-1-benzothiophen-2-yl)acetamide?
N-(6-hydroxy-1-benzothiophen-2-yl)acetamide has a molecular weight of 207.25 g/mol, XLogP of 2.57, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-hydroxy-1-benzothiophen-2-yl)acetamide is sourced from PubChem (CID 157022042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).