2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine

C12H10Cl3NS — CID 83987226

IUPAC2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine
SMILESNCC(c1ccc(Cl)s1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H10Cl3NS/c13-8-2-1-3-9(14)12(8)7(6-16)10-4-5-11(15)17-10/h1-5,7H,6,16H2
InChIKeyFRTYPYYQCTYZAH-UHFFFAOYSA-N
MW306.65 g/mol
LogP4.80
Rot. Bonds3

About 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine

2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine (PubChem CID 83987226) has the molecular formula C12H10Cl3NS and a molecular weight of 306.65 g/mol. Its IUPAC name is 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine.

Molecular Properties

Compound Name2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine
PubChem CID83987226
Molecular FormulaC12H10Cl3NS
Molecular Weight306.65 g/mol
Exact Mass304.96
IUPAC Name2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine
SMILESNCC(c1ccc(Cl)s1)c1c(Cl)cccc1Cl
InChIInChI=1S/C12H10Cl3NS/c13-8-2-1-3-9(14)12(8)7(6-16)10-4-5-11(15)17-10/h1-5,7H,6,16H2
InChIKeyFRTYPYYQCTYZAH-UHFFFAOYSA-N
XLogP4.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.65
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine 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-(1,3-benzothiazol-2-yl)-2-(5-chlorothiophen-2-yl)ethanamine
CID 83987490
(2R)-2-(2,6-dichlorophenyl)-2-phenylethanamine
CID 125466281
2-(5-chlorothiophen-2-yl)-2-pyridazin-3-ylethanamine
CID 116833571
(1R)-1-(2,6-dichlorophenyl)ethane-1,2-diamine;hydrochloride
CID 171217423
(1S)-1-(5-chlorothiophen-2-yl)propane-1,3-diamine;hydrochloride
CID 171220102
3-(5-chlorothiophen-2-yl)-3-(4-methylphenyl)propan-1-amine
CID 82091891
2-(5-chlorothiophen-2-yl)-1-(2,6-dichlorophenyl)ethanol
CID 65150596
(3-chloro-2-pyridinyl)-(5-chlorothiophen-2-yl)methanamine
CID 103443950
3-amino-1-(2,6-dichlorophenyl)propane-1,2-diol
CID 170827623
2-(2-chloro-6-fluorophenyl)-1-(5-chlorothiophen-2-yl)ethanol
CID 61087611
1-(5-chlorothiophen-2-yl)-N-methyl-N-(2-pyrrolidin-1-ylethyl)ethane-1,2-diamine
CID 63206934
3-amino-2-(3-bromophenyl)-1-(5-chlorothiophen-2-yl)propan-1-ol
CID 65187605

Frequently Asked Questions

What is the IUPAC name of 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine?
The IUPAC name of 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine (CID 83987226) is 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine.
What is the SMILES notation for 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine?
The canonical SMILES for 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine is NCC(c1ccc(Cl)s1)c1c(Cl)cccc1Cl.
What is the InChIKey of 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine?
The InChIKey is FRTYPYYQCTYZAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl3NS/c13-8-2-1-3-9(14)12(8)7(6-16)10-4-5-11(15)17-10/h1-5,7H,6,16H2.
What are the key properties of 2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine?
2-(5-chlorothiophen-2-yl)-2-(2,6-dichlorophenyl)ethanamine has a molecular weight of 306.65 g/mol, XLogP of 4.80, 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-(2,6-dichlorophenyl)ethanamine is sourced from PubChem (CID 83987226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).