3-(2-methoxyphenyl)-1-benzothiophene

C15H12OS — CID 3358919

IUPAC3-(2-methoxyphenyl)-1-benzothiophene
SMILESCOc1ccccc1-c1csc2ccccc12
InChIInChI=1S/C15H12OS/c1-16-14-8-4-2-6-11(14)13-10-17-15-9-5-3-7-12(13)15/h2-10H,1H3
InChIKeyRSMARNKQSFLTBY-UHFFFAOYSA-N
MW240.33 g/mol
LogP4.58
Rot. Bonds2

About 3-(2-methoxyphenyl)-1-benzothiophene

3-(2-methoxyphenyl)-1-benzothiophene (PubChem CID 3358919) has the molecular formula C15H12OS and a molecular weight of 240.33 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-1-benzothiophene.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-1-benzothiophene
PubChem CID3358919
Molecular FormulaC15H12OS
Molecular Weight240.33 g/mol
Exact Mass240.06
IUPAC Name3-(2-methoxyphenyl)-1-benzothiophene
SMILESCOc1ccccc1-c1csc2ccccc12
InChIInChI=1S/C15H12OS/c1-16-14-8-4-2-6-11(14)13-10-17-15-9-5-3-7-12(13)15/h2-10H,1H3
InChIKeyRSMARNKQSFLTBY-UHFFFAOYSA-N
XLogP4.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.33
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-bromophenyl)-1-benzothiophene
CID 134529579
3-(1-benzothiophen-3-yl)-6,7,8-trimethoxychromen-4-one
CID 166635823
3-[(2-methoxyphenoxy)methyl]-1-benzothiophene
CID 117170894
1-[2-(2-methoxyphenyl)phenyl]naphthalene
CID 175027379
1,4-dimethoxy-2-(2-methoxyphenyl)naphthalene
CID 161363992
4-methoxy-3-(4-methoxyphenyl)-1-benzothiophene
CID 15422647
3-[1-bromo-2-(2-methoxyphenyl)ethyl]-1-benzothiophene
CID 63441042
4-(2-methoxyphenyl)-2-phenylthiophene
CID 102031786
3-[1-chloro-2-(2-methoxyphenyl)ethyl]-1-benzothiophene
CID 63433316
(2-amino-6-methoxyphenyl)-(1-benzothiophen-3-yl)methanone
CID 81414226
2-(1-benzothiophen-3-yl)-N-tri(propan-2-yl)silylaniline
CID 139252450
CID 10968300
CID 10968300

Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-1-benzothiophene?
The IUPAC name of 3-(2-methoxyphenyl)-1-benzothiophene (CID 3358919) is 3-(2-methoxyphenyl)-1-benzothiophene.
What is the SMILES notation for 3-(2-methoxyphenyl)-1-benzothiophene?
The canonical SMILES for 3-(2-methoxyphenyl)-1-benzothiophene is COc1ccccc1-c1csc2ccccc12.
What is the InChIKey of 3-(2-methoxyphenyl)-1-benzothiophene?
The InChIKey is RSMARNKQSFLTBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12OS/c1-16-14-8-4-2-6-11(14)13-10-17-15-9-5-3-7-12(13)15/h2-10H,1H3.
What are the key properties of 3-(2-methoxyphenyl)-1-benzothiophene?
3-(2-methoxyphenyl)-1-benzothiophene has a molecular weight of 240.33 g/mol, XLogP of 4.58, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-1-benzothiophene is sourced from PubChem (CID 3358919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).