3-methoxy-2-phenylthiophene

C11H10OS — CID 19905010

IUPAC3-methoxy-2-phenylthiophene
SMILESCOc1ccsc1-c1ccccc1
InChIInChI=1S/C11H10OS/c1-12-10-7-8-13-11(10)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyCCPNMKSJXRMJJE-UHFFFAOYSA-N
MW190.27 g/mol
LogP3.42
Rot. Bonds2

About 3-methoxy-2-phenylthiophene

3-methoxy-2-phenylthiophene (PubChem CID 19905010) has the molecular formula C11H10OS and a molecular weight of 190.27 g/mol. Its IUPAC name is 3-methoxy-2-phenylthiophene.

Molecular Properties

Compound Name3-methoxy-2-phenylthiophene
PubChem CID19905010
Molecular FormulaC11H10OS
Molecular Weight190.27 g/mol
Exact Mass190.05
IUPAC Name3-methoxy-2-phenylthiophene
SMILESCOc1ccsc1-c1ccccc1
InChIInChI=1S/C11H10OS/c1-12-10-7-8-13-11(10)9-5-3-2-4-6-9/h2-8H,1H3
InChIKeyCCPNMKSJXRMJJE-UHFFFAOYSA-N
XLogP3.42
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-methoxy-2-(3-methoxythiophen-2-yl)thiophene
CID 10609306
3-methoxy-2-thiophen-2-ylthiophene
CID 18353954
5-(3-methoxythiophen-2-yl)-3-phenyl-1H-1,2,4-triazole
CID 81121779
methyl 2-(3-methoxythiophen-2-yl)benzoate
CID 141479159
2-(3-methoxythiophen-2-yl)-4-methyl-1-phenylpyrrole
CID 132559823
2-phenyl-3-(2-phenylthiophen-3-yl)sulfanylthiophene
CID 54495685
2-[bromo-(4-phenylphenyl)methyl]-3-methoxythiophene
CID 81119082
1,3-dimethoxy-2-phenylbenzene;hydrochloride
CID 175871248
3-phenyl-2-[4-(3-phenylthiophen-2-yl)phenyl]thiophene
CID 67533042
3-phenyl-2-(4-phenylphenyl)thiophene
CID 70178548
3-[3,5-bis(2-phenylthiophen-3-yl)phenyl]-2-phenylthiophene
CID 58130450
3-[5-(3-methoxythiophen-2-yl)-1,2,4-oxadiazol-3-yl]benzoic acid
CID 81119623

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-phenylthiophene?
The IUPAC name of 3-methoxy-2-phenylthiophene (CID 19905010) is 3-methoxy-2-phenylthiophene.
What is the SMILES notation for 3-methoxy-2-phenylthiophene?
The canonical SMILES for 3-methoxy-2-phenylthiophene is COc1ccsc1-c1ccccc1.
What is the InChIKey of 3-methoxy-2-phenylthiophene?
The InChIKey is CCPNMKSJXRMJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10OS/c1-12-10-7-8-13-11(10)9-5-3-2-4-6-9/h2-8H,1H3.
What are the key properties of 3-methoxy-2-phenylthiophene?
3-methoxy-2-phenylthiophene has a molecular weight of 190.27 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-phenylthiophene is sourced from PubChem (CID 19905010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).