6-fluoro-1-benzothiophen-2-amine

C8H6FNS — CID 82597319

IUPAC6-fluoro-1-benzothiophen-2-amine
SMILESNc1cc2ccc(F)cc2s1
InChIInChI=1S/C8H6FNS/c9-6-2-1-5-3-8(10)11-7(5)4-6/h1-4H,10H2
InChIKeyAADLNIKSBPESRM-UHFFFAOYSA-N
MW167.21 g/mol
LogP2.62
Rot. Bonds

About 6-fluoro-1-benzothiophen-2-amine

6-fluoro-1-benzothiophen-2-amine (PubChem CID 82597319) has the molecular formula C8H6FNS and a molecular weight of 167.21 g/mol. Its IUPAC name is 6-fluoro-1-benzothiophen-2-amine.

Molecular Properties

Compound Name6-fluoro-1-benzothiophen-2-amine
PubChem CID82597319
Molecular FormulaC8H6FNS
Molecular Weight167.21 g/mol
Exact Mass167.02
IUPAC Name6-fluoro-1-benzothiophen-2-amine
SMILESNc1cc2ccc(F)cc2s1
InChIInChI=1S/C8H6FNS/c9-6-2-1-5-3-8(10)11-7(5)4-6/h1-4H,10H2
InChIKeyAADLNIKSBPESRM-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

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Related Compounds

1-(6-fluoro-1-benzothiophen-2-yl)-N-methylmethanamine
CID 81105075
2-amino-1-benzothiophene-6-carbonitrile
CID 46908319
1-benzothiophen-2-amine;hydrochloride
CID 66906726
5-(6-fluoro-1-benzothiophen-2-yl)-1H-1,2,4-triazol-3-amine
CID 81104224
(6-fluoro-1-benzothiophen-2-yl)-(2,4,6-trifluorophenyl)methanamine
CID 81115335
1-(6-fluoro-1-benzothiophen-2-yl)propan-1-amine
CID 114979546
3-amino-5-(6-fluoro-1-benzothiophen-2-yl)thiophene-2-carboxylic acid
CID 83035556
6-fluoro-5-iodo-1-benzothiophen-2-amine
CID 130788727
2-N-[(6-fluoro-1-benzothiophen-2-yl)methyl]-3-methylbutane-1,2-diamine
CID 106345477
N-(2-amino-5-fluorophenyl)-6-fluoro-1-benzothiophene-2-carboxamide
CID 81105328
4-(6-fluoro-1-benzothiophen-2-yl)-6-methylsulfanyl-1,3,5-triazin-2-amine
CID 83084823
6-fluoro-1,3-benzothiazol-2-amine;hydrobromide
CID 139217681

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1-benzothiophen-2-amine?
The IUPAC name of 6-fluoro-1-benzothiophen-2-amine (CID 82597319) is 6-fluoro-1-benzothiophen-2-amine.
What is the SMILES notation for 6-fluoro-1-benzothiophen-2-amine?
The canonical SMILES for 6-fluoro-1-benzothiophen-2-amine is Nc1cc2ccc(F)cc2s1.
What is the InChIKey of 6-fluoro-1-benzothiophen-2-amine?
The InChIKey is AADLNIKSBPESRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6FNS/c9-6-2-1-5-3-8(10)11-7(5)4-6/h1-4H,10H2.
What are the key properties of 6-fluoro-1-benzothiophen-2-amine?
6-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 6-fluoro-1-benzothiophen-2-amine is sourced from PubChem (CID 82597319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).