2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine

C14H16FNOS — CID 83974815

IUPAC2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine
SMILESCOc1ccc(F)cc1C(CN)Cc1cccs1
InChIInChI=1S/C14H16FNOS/c1-17-14-5-4-11(15)8-13(14)10(9-16)7-12-3-2-6-18-12/h2-6,8,10H,7,9,16H2,1H3
InChIKeyDPWIBBLHFIAFDM-UHFFFAOYSA-N
MW265.35 g/mol
LogP3.18
Rot. Bonds5

About 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine

2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine (PubChem CID 83974815) has the molecular formula C14H16FNOS and a molecular weight of 265.35 g/mol. Its IUPAC name is 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine
PubChem CID83974815
Molecular FormulaC14H16FNOS
Molecular Weight265.35 g/mol
Exact Mass265.09
IUPAC Name2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine
SMILESCOc1ccc(F)cc1C(CN)Cc1cccs1
InChIInChI=1S/C14H16FNOS/c1-17-14-5-4-11(15)8-13(14)10(9-16)7-12-3-2-6-18-12/h2-6,8,10H,7,9,16H2,1H3
InChIKeyDPWIBBLHFIAFDM-UHFFFAOYSA-N
XLogP3.18
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.35
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine?
The IUPAC name of 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine (CID 83974815) is 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine.
What is the SMILES notation for 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine?
The canonical SMILES for 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine is COc1ccc(F)cc1C(CN)Cc1cccs1.
What is the InChIKey of 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine?
The InChIKey is DPWIBBLHFIAFDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FNOS/c1-17-14-5-4-11(15)8-13(14)10(9-16)7-12-3-2-6-18-12/h2-6,8,10H,7,9,16H2,1H3.
What are the key properties of 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine?
2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine has a molecular weight of 265.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-methoxyphenyl)-3-thiophen-2-ylpropan-1-amine is sourced from PubChem (CID 83974815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).