2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine

C15H16ClNS — CID 55014728

IUPAC2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine
SMILESCc1ccccc1SC(CN)c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClNS/c1-11-4-2-3-5-14(11)18-15(10-17)12-6-8-13(16)9-7-12/h2-9,15H,10,17H2,1H3
InChIKeyQYUNSUZKYSWLQN-UHFFFAOYSA-N
MW277.82 g/mol
LogP4.44
Rot. Bonds4

About 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine

2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine (PubChem CID 55014728) has the molecular formula C15H16ClNS and a molecular weight of 277.82 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine.

Molecular Properties

Compound Name2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine
PubChem CID55014728
Molecular FormulaC15H16ClNS
Molecular Weight277.82 g/mol
Exact Mass277.07
IUPAC Name2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine
SMILESCc1ccccc1SC(CN)c1ccc(Cl)cc1
InChIInChI=1S/C15H16ClNS/c1-11-4-2-3-5-14(11)18-15(10-17)12-6-8-13(16)9-7-12/h2-9,15H,10,17H2,1H3
InChIKeyQYUNSUZKYSWLQN-UHFFFAOYSA-N
XLogP4.44
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.82
LogP ≤ 54.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine 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-(4-fluorophenyl)-2-(2-methylphenyl)sulfanylethanamine
CID 55014987
2-(2-methylphenyl)-2-(2-methylphenyl)sulfanylethanamine
CID 55019111
1-(4-chlorophenyl)-1-(2-methylphenyl)sulfanylpropan-2-amine
CID 55015536
2-(2-chlorophenyl)sulfanyl-2-phenylethanamine
CID 55017174
2-(2,5-dimethylphenyl)sulfanyl-2-phenylethanamine
CID 55017309
2-(4-chlorophenyl)-2-[(4,6-dimethyl-2-pyridinyl)sulfanyl]ethanamine
CID 102924820
2-(4-chlorophenyl)sulfanyl-2-(4-methoxyphenyl)ethanamine
CID 55015675
2-(4-methylphenyl)-2-phenylsulfanylethanamine
CID 55016324
1-(4-chlorophenyl)-N-methyl-2-(2-methylphenyl)sulfanylethanamine
CID 66099055
3,3,3-trifluoro-2-(2-methylphenyl)sulfanylpropan-1-amine
CID 60891622
1-[(E)-2-chloroethenyl]sulfanyl-2-methylbenzene
CID 131233381
1-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanone
CID 51889916

Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine?
The IUPAC name of 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine (CID 55014728) is 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine.
What is the SMILES notation for 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine?
The canonical SMILES for 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine is Cc1ccccc1SC(CN)c1ccc(Cl)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine?
The InChIKey is QYUNSUZKYSWLQN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClNS/c1-11-4-2-3-5-14(11)18-15(10-17)12-6-8-13(16)9-7-12/h2-9,15H,10,17H2,1H3.
What are the key properties of 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine?
2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine has a molecular weight of 277.82 g/mol, XLogP of 4.44, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-2-(2-methylphenyl)sulfanylethanamine is sourced from PubChem (CID 55014728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).