7-fluoro-1-benzothiophen-2-amine

C8H6FNS — CID 82597320

IUPAC7-fluoro-1-benzothiophen-2-amine
SMILESNc1cc2cccc(F)c2s1
InChIInChI=1S/C8H6FNS/c9-6-3-1-2-5-4-7(10)11-8(5)6/h1-4H,10H2
InChIKeyMGHFTESCPXGZDM-UHFFFAOYSA-N
MW167.21 g/mol
LogP2.62
Rot. Bonds

About 7-fluoro-1-benzothiophen-2-amine

7-fluoro-1-benzothiophen-2-amine (PubChem CID 82597320) has the molecular formula C8H6FNS and a molecular weight of 167.21 g/mol. Its IUPAC name is 7-fluoro-1-benzothiophen-2-amine.

Molecular Properties

Compound Name7-fluoro-1-benzothiophen-2-amine
PubChem CID82597320
Molecular FormulaC8H6FNS
Molecular Weight167.21 g/mol
Exact Mass167.02
IUPAC Name7-fluoro-1-benzothiophen-2-amine
SMILESNc1cc2cccc(F)c2s1
InChIInChI=1S/C8H6FNS/c9-6-3-1-2-5-4-7(10)11-8(5)6/h1-4H,10H2
InChIKeyMGHFTESCPXGZDM-UHFFFAOYSA-N
XLogP2.62
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.21
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-fluoro-1-benzothiophen-2-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

4-(Benzo[b]thiophen-2-yl)aniline
CID 4127352
2-Amino-1-benzothiophene-3-carbonitrile
CID 23273581
1-Benzothiophen-6-amine
CID 220591
Benzo(b)thiophen-4-ylamine
CID 298484
Benzo(b)thiophen-5-amine
CID 288032
1-Benzothiophen-3-amine
CID 11194423
2-Isocyanato-1-benzothiophene
CID 15658399
2-(Benzo[b]thiophen-2-yl)aniline
CID 23540731
(5-Fluoro-1-benzothiophen-2-yl)methanamine
CID 39869113
1-Benzothiophen-5-amine hydrochloride
CID 16336012
(5-Fluoro-1-benzothiophen-2-yl)methanamine hydrochloride
CID 42962700
1-Benzothiophen-7-amine hydrochloride
CID 71756956

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-1-benzothiophen-2-amine?
The IUPAC name of 7-fluoro-1-benzothiophen-2-amine (CID 82597320) is 7-fluoro-1-benzothiophen-2-amine.
What is the SMILES notation for 7-fluoro-1-benzothiophen-2-amine?
The canonical SMILES for 7-fluoro-1-benzothiophen-2-amine is Nc1cc2cccc(F)c2s1.
What is the InChIKey of 7-fluoro-1-benzothiophen-2-amine?
The InChIKey is MGHFTESCPXGZDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNS/c9-6-3-1-2-5-4-7(10)11-8(5)6/h1-4H,10H2.
What are the key properties of 7-fluoro-1-benzothiophen-2-amine?
7-fluoro-1-benzothiophen-2-amine has a molecular weight of 167.21 g/mol, XLogP of 2.62, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-1-benzothiophen-2-amine is sourced from PubChem (CID 82597320), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).