1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine

C15H15Cl2NS — CID 62647172

IUPAC1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine
SMILESCC(N)C(Sc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C15H15Cl2NS/c1-10(18)15(11-4-2-5-12(16)8-11)19-14-7-3-6-13(17)9-14/h2-10,15H,18H2,1H3
InChIKeyPJNWWJCUBZQKRH-UHFFFAOYSA-N
MW312.27 g/mol
LogP5.17
Rot. Bonds4

About 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine

1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine (PubChem CID 62647172) has the molecular formula C15H15Cl2NS and a molecular weight of 312.27 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine
PubChem CID62647172
Molecular FormulaC15H15Cl2NS
Molecular Weight312.27 g/mol
Exact Mass311.03
IUPAC Name1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine
SMILESCC(N)C(Sc1cccc(Cl)c1)c1cccc(Cl)c1
InChIInChI=1S/C15H15Cl2NS/c1-10(18)15(11-4-2-5-12(16)8-11)19-14-7-3-6-13(17)9-14/h2-10,15H,18H2,1H3
InChIKeyPJNWWJCUBZQKRH-UHFFFAOYSA-N
XLogP5.17
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.27
LogP ≤ 55.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine 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-(3-chlorophenyl)sulfanyl-1-(3-methylphenyl)propan-2-amine
CID 62645584
1-(4-bromophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine
CID 63537081
1-(3-chlorophenyl)sulfanyl-1-(2-fluorophenyl)propan-2-amine
CID 55101417
1-(3-chlorophenyl)sulfanyl-1-(5-methylthiophen-2-yl)propan-2-amine
CID 62646460
1-(3-chlorophenyl)sulfanyl-1-(3-methylthiophen-2-yl)propan-2-amine
CID 62646457
1-chloro-3-propan-2-ylsulfanylbenzene
CID 12763281
1-(3-methylphenyl)sulfanyl-1-phenylpropan-2-amine
CID 55017009
1-(3-methylphenyl)-1-phenylsulfanylpropan-2-amine
CID 55020378
1-(3-chlorophenyl)-1-(2,5-dimethylpyrazol-3-yl)sulfanylpropan-2-amine
CID 62409941
(1S)-1-[4-(3-chlorophenyl)sulfanylphenyl]ethanamine
CID 63371446
2-[2-amino-1-(3-chlorophenyl)propyl]sulfanyl-N,N-dimethylacetamide
CID 114233522
2-amino-2-(3-chlorophenyl)sulfanylethanol
CID 117034655

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine?
The IUPAC name of 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine (CID 62647172) is 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine.
What is the SMILES notation for 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine?
The canonical SMILES for 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine is CC(N)C(Sc1cccc(Cl)c1)c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine?
The InChIKey is PJNWWJCUBZQKRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NS/c1-10(18)15(11-4-2-5-12(16)8-11)19-14-7-3-6-13(17)9-14/h2-10,15H,18H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine?
1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine has a molecular weight of 312.27 g/mol, XLogP of 5.17, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-1-(3-chlorophenyl)sulfanylpropan-2-amine is sourced from PubChem (CID 62647172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).