2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride

C14H15Cl2N — CID 3052534

IUPAC2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride
SMILESCl.NC(Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C14H14ClN.ClH/c15-13-8-4-5-11(9-13)10-14(16)12-6-2-1-3-7-12;/h1-9,14H,10,16H2;1H
InChIKeyUQOHZGNSITVOJV-UHFFFAOYSA-N
MW268.19 g/mol
LogP4.00
Rot. Bonds3

About 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride

2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride (PubChem CID 3052534) has the molecular formula C14H15Cl2N and a molecular weight of 268.19 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride
PubChem CID3052534
Molecular FormulaC14H15Cl2N
Molecular Weight268.19 g/mol
Exact Mass267.06
IUPAC Name2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride
SMILESCl.NC(Cc1cccc(Cl)c1)c1ccccc1
InChIInChI=1S/C14H14ClN.ClH/c15-13-8-4-5-11(9-13)10-14(16)12-6-2-1-3-7-12;/h1-9,14H,10,16H2;1H
InChIKeyUQOHZGNSITVOJV-UHFFFAOYSA-N
XLogP4.00
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.19
LogP ≤ 54.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride 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-chlorophenyl)-1-phenylethanamine;hydrochloride
CID 3052629
2-(3-fluorophenyl)-1-phenylethanamine;hydrochloride
CID 25032833
1-chloro-3-(2-chloro-2-phenylethyl)benzene
CID 4737542
1-(3-chlorophenyl)-2-(3,4-dichlorophenyl)ethanamine
CID 55139269
2-(3-chloro-4-fluorophenyl)-1-phenylethanamine
CID 81144923
2-(3-chlorophenyl)-1-thiophen-2-ylethanamine;hydrochloride
CID 3061996
2-(3-chlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 79704483
2-(3-chlorophenyl)-1-(3,4-dimethoxyphenyl)ethanamine
CID 3052546
1-(3-bromo-5-fluorophenyl)-2-(3-chlorophenyl)ethanamine
CID 62504437
1-(4-chlorophenyl)-2-(3-fluorophenyl)ethanamine
CID 43184847
2-(3-bromophenyl)-1-(4-chlorophenyl)ethanamine
CID 60820505
1-(5-chlorofuran-2-yl)-2-(3-chlorophenyl)ethanamine
CID 106687882

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride?
The IUPAC name of 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride (CID 3052534) is 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride.
What is the SMILES notation for 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride?
The canonical SMILES for 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride is Cl.NC(Cc1cccc(Cl)c1)c1ccccc1.
What is the InChIKey of 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride?
The InChIKey is UQOHZGNSITVOJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClN.ClH/c15-13-8-4-5-11(9-13)10-14(16)12-6-2-1-3-7-12;/h1-9,14H,10,16H2;1H.
What are the key properties of 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride?
2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride has a molecular weight of 268.19 g/mol, XLogP of 4.00, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride is sourced from PubChem (CID 3052534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).