2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine

C7H9ClFNS — CID 105425161

IUPAC2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine
SMILESCNCC(F)c1ccc(Cl)s1
InChIInChI=1S/C7H9ClFNS/c1-10-4-5(9)6-2-3-7(8)11-6/h2-3,5,10H,4H2,1H3
InChIKeyCZSYCAOHNXHGGQ-UHFFFAOYSA-N
MW193.67 g/mol
LogP2.63
Rot. Bonds3

About 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine

2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine (PubChem CID 105425161) has the molecular formula C7H9ClFNS and a molecular weight of 193.67 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine
PubChem CID105425161
Molecular FormulaC7H9ClFNS
Molecular Weight193.67 g/mol
Exact Mass193.01
IUPAC Name2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine
SMILESCNCC(F)c1ccc(Cl)s1
InChIInChI=1S/C7H9ClFNS/c1-10-4-5(9)6-2-3-7(8)11-6/h2-3,5,10H,4H2,1H3
InChIKeyCZSYCAOHNXHGGQ-UHFFFAOYSA-N
XLogP2.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.67
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine 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

1-(5-chlorothiophen-2-yl)-2-(methylamino)ethanol
CID 79002149
(5-chlorothiophen-2-yl)-(methylamino)methanethiol
CID 116954482
N-[1-(5-chlorothiophen-2-yl)ethyl]-2,3,3-trimethylbutan-1-amine
CID 83141725
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517
1-(5-chlorothiophen-2-yl)-N-(2-fluoroethyl)ethanamine
CID 80696138
1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol
CID 61088930
2-chloro-5-(1-chloropropyl)thiophene
CID 61086027
[1-(5-chlorothiophen-2-yl)-2,2-difluoroethyl]hydrazine
CID 105265155
1-(5-chlorothiophen-2-yl)-N-methyl-1-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116958541
(5-chlorothiophen-2-yl)-[1-(methylaminomethyl)cyclopropyl]methanamine
CID 116943525
1-(5-chlorothiophen-2-yl)-N'-ethyl-N,N-dimethylethane-1,2-diamine
CID 116905875
2-(tert-butylamino)-1-(5-chlorothiophen-2-yl)ethanol
CID 3039980

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine (CID 105425161) is 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine is CNCC(F)c1ccc(Cl)s1.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine?
The InChIKey is CZSYCAOHNXHGGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClFNS/c1-10-4-5(9)6-2-3-7(8)11-6/h2-3,5,10H,4H2,1H3.
What are the key properties of 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine?
2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine has a molecular weight of 193.67 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chlorothiophen-2-yl)-2-fluoro-N-methylethanamine is sourced from PubChem (CID 105425161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).