1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine

C14H15ClFNS — CID 61078384

IUPAC1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cc(Cl)ccc1F
InChIInChI=1S/C14H15ClFNS/c1-2-17-14(7-10-5-6-18-9-10)12-8-11(15)3-4-13(12)16/h3-6,8-9,14,17H,2,7H2,1H3
InChIKeyYHQUVQPANGYVDG-UHFFFAOYSA-N
MW283.80 g/mol
LogP4.43
Rot. Bonds5

About 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine

1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine (PubChem CID 61078384) has the molecular formula C14H15ClFNS and a molecular weight of 283.80 g/mol. Its IUPAC name is 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine.

Molecular Properties

Compound Name1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine
PubChem CID61078384
Molecular FormulaC14H15ClFNS
Molecular Weight283.80 g/mol
Exact Mass283.06
IUPAC Name1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine
SMILESCCNC(Cc1ccsc1)c1cc(Cl)ccc1F
InChIInChI=1S/C14H15ClFNS/c1-2-17-14(7-10-5-6-18-9-10)12-8-11(15)3-4-13(12)16/h3-6,8-9,14,17H,2,7H2,1H3
InChIKeyYHQUVQPANGYVDG-UHFFFAOYSA-N
XLogP4.43
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.80
LogP ≤ 54.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine 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-(2-bromo-5-chlorophenyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 114027019
1-(5-chloro-2-fluorophenyl)-N-ethylpropan-1-amine
CID 114886330
1-(5-bromo-2-fluorophenyl)-N-ethyl-3-thiophen-3-ylpropan-1-amine
CID 114894917
1-(5-chloro-2-fluorophenyl)-2-(2,6-dichlorophenyl)-N-ethylethanamine
CID 114886290
2-(4-chlorophenyl)-N-ethyl-1-(2-fluoro-5-methylphenyl)ethanamine
CID 63412865
N-ethyl-1-(3-fluorophenyl)-2-thiophen-3-ylethanamine
CID 61078915
N-ethyl-1-[2-methyl-4-(trifluoromethyl)phenyl]-2-thiophen-3-ylethanamine
CID 102757512
1-(5-chloro-2-fluorophenyl)-2-(2-chlorophenyl)-N-ethylethanamine
CID 63527546
N-ethyl-1-(2-iodophenyl)-2-thiophen-3-ylethanamine
CID 61078733
1-(3-chloro-4-methylphenyl)-N-ethyl-2-thiophen-3-ylethanamine
CID 55162373
N-[1-(5-chloro-2-fluorophenyl)-2-(4-chlorophenyl)ethyl]propan-1-amine
CID 63527400
1-(3-chlorophenyl)-N-ethyl-3-thiophen-3-ylpropan-2-amine
CID 55095489

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine?
The IUPAC name of 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine (CID 61078384) is 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine.
What is the SMILES notation for 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine?
The canonical SMILES for 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine is CCNC(Cc1ccsc1)c1cc(Cl)ccc1F.
What is the InChIKey of 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine?
The InChIKey is YHQUVQPANGYVDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClFNS/c1-2-17-14(7-10-5-6-18-9-10)12-8-11(15)3-4-13(12)16/h3-6,8-9,14,17H,2,7H2,1H3.
What are the key properties of 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine?
1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine has a molecular weight of 283.80 g/mol, XLogP of 4.43, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-2-fluorophenyl)-N-ethyl-2-thiophen-3-ylethanamine is sourced from PubChem (CID 61078384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).