N-(2-fluorophenyl)-1-benzothiophen-3-amine

C14H10FNS — CID 45270419

IUPACN-(2-fluorophenyl)-1-benzothiophen-3-amine
SMILESFc1ccccc1Nc1csc2ccccc12
InChIInChI=1S/C14H10FNS/c15-11-6-2-3-7-12(11)16-13-9-17-14-8-4-1-5-10(13)14/h1-9,16H
InChIKeyPWJGQNJODBBPTQ-UHFFFAOYSA-N
MW243.31 g/mol
LogP4.78
Rot. Bonds2

About N-(2-fluorophenyl)-1-benzothiophen-3-amine

N-(2-fluorophenyl)-1-benzothiophen-3-amine (PubChem CID 45270419) has the molecular formula C14H10FNS and a molecular weight of 243.31 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1-benzothiophen-3-amine.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1-benzothiophen-3-amine
PubChem CID45270419
Molecular FormulaC14H10FNS
Molecular Weight243.31 g/mol
Exact Mass243.05
IUPAC NameN-(2-fluorophenyl)-1-benzothiophen-3-amine
SMILESFc1ccccc1Nc1csc2ccccc12
InChIInChI=1S/C14H10FNS/c15-11-6-2-3-7-12(11)16-13-9-17-14-8-4-1-5-10(13)14/h1-9,16H
InChIKeyPWJGQNJODBBPTQ-UHFFFAOYSA-N
XLogP4.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 54.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-(2-fluorophenyl)-1-benzothiophen-3-amine with MolForge

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

Launch Full Analysis

Related Compounds

2-N-(1-benzothiophen-3-yl)-3-fluorobenzene-1,2-diamine
CID 115125641
2-(1-benzothiophen-3-ylamino)benzoic acid
CID 125468623
N-triphenylen-2-yl-1-benzothiophen-3-amine
CID 171751374
N-(1-benzothiophen-3-yl)pyridin-2-amine
CID 19360249
N-(bromomethyl)-1-benzothiophen-3-amine
CID 115261633
[6-(1-benzothiophen-3-ylamino)pyrimidin-4-yl]cyanamide
CID 115264535
4-N-(2-fluorophenyl)-1-N-methylbenzene-1,4-diamine
CID 117027231
1-benzothiophen-3-yl-(2,6-difluorophenyl)methanamine
CID 43150877
N-[(E)-3-chloroprop-2-enyl]-1-benzothiophen-3-amine
CID 131233393
N-(2-fluorophenyl)-1,3-thiazol-2-amine
CID 82537266
N-(1-benzothiophen-3-ylmethyl)-2-(2-fluorophenyl)ethanamine
CID 60704446
3-(1-benzothiophen-3-ylamino)propane-1,2-diol
CID 115121939

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1-benzothiophen-3-amine?
The IUPAC name of N-(2-fluorophenyl)-1-benzothiophen-3-amine (CID 45270419) is N-(2-fluorophenyl)-1-benzothiophen-3-amine.
What is the SMILES notation for N-(2-fluorophenyl)-1-benzothiophen-3-amine?
The canonical SMILES for N-(2-fluorophenyl)-1-benzothiophen-3-amine is Fc1ccccc1Nc1csc2ccccc12.
What is the InChIKey of N-(2-fluorophenyl)-1-benzothiophen-3-amine?
The InChIKey is PWJGQNJODBBPTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FNS/c15-11-6-2-3-7-12(11)16-13-9-17-14-8-4-1-5-10(13)14/h1-9,16H.
What are the key properties of N-(2-fluorophenyl)-1-benzothiophen-3-amine?
N-(2-fluorophenyl)-1-benzothiophen-3-amine has a molecular weight of 243.31 g/mol, XLogP of 4.78, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1-benzothiophen-3-amine is sourced from PubChem (CID 45270419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).