4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine

C11H10FNOS — CID 82128004

IUPAC4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine
SMILESCOc1ccc(-c2csc(N)c2)cc1F
InChIInChI=1S/C11H10FNOS/c1-14-10-3-2-7(4-9(10)12)8-5-11(13)15-6-8/h2-6H,13H2,1H3
InChIKeyXVRBSZBDIPCUSL-UHFFFAOYSA-N
MW223.27 g/mol
LogP3.14
Rot. Bonds2

About 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine

4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine (PubChem CID 82128004) has the molecular formula C11H10FNOS and a molecular weight of 223.27 g/mol. Its IUPAC name is 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine.

Molecular Properties

Compound Name4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine
PubChem CID82128004
Molecular FormulaC11H10FNOS
Molecular Weight223.27 g/mol
Exact Mass223.05
IUPAC Name4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine
SMILESCOc1ccc(-c2csc(N)c2)cc1F
InChIInChI=1S/C11H10FNOS/c1-14-10-3-2-7(4-9(10)12)8-5-11(13)15-6-8/h2-6H,13H2,1H3
InChIKeyXVRBSZBDIPCUSL-UHFFFAOYSA-N
XLogP3.14
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine?
The IUPAC name of 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine (CID 82128004) is 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine.
What is the SMILES notation for 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine?
The canonical SMILES for 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine is COc1ccc(-c2csc(N)c2)cc1F.
What is the InChIKey of 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine?
The InChIKey is XVRBSZBDIPCUSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNOS/c1-14-10-3-2-7(4-9(10)12)8-5-11(13)15-6-8/h2-6H,13H2,1H3.
What are the key properties of 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine?
4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine has a molecular weight of 223.27 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-fluoro-4-methoxyphenyl)thiophen-2-amine is sourced from PubChem (CID 82128004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).