2-(2,6-dichlorophenyl)-1-phenylethanamine

C14H13Cl2N — CID 55133818

IUPAC2-(2,6-dichlorophenyl)-1-phenylethanamine
SMILESNC(Cc1c(Cl)cccc1Cl)c1ccccc1
InChIInChI=1S/C14H13Cl2N/c15-12-7-4-8-13(16)11(12)9-14(17)10-5-2-1-3-6-10/h1-8,14H,9,17H2
InChIKeySUPBSQOBQDGTOE-UHFFFAOYSA-N
MW266.17 g/mol
LogP4.24
Rot. Bonds3

About 2-(2,6-dichlorophenyl)-1-phenylethanamine

2-(2,6-dichlorophenyl)-1-phenylethanamine (PubChem CID 55133818) has the molecular formula C14H13Cl2N and a molecular weight of 266.17 g/mol. Its IUPAC name is 2-(2,6-dichlorophenyl)-1-phenylethanamine.

Molecular Properties

Compound Name2-(2,6-dichlorophenyl)-1-phenylethanamine
PubChem CID55133818
Molecular FormulaC14H13Cl2N
Molecular Weight266.17 g/mol
Exact Mass265.04
IUPAC Name2-(2,6-dichlorophenyl)-1-phenylethanamine
SMILESNC(Cc1c(Cl)cccc1Cl)c1ccccc1
InChIInChI=1S/C14H13Cl2N/c15-12-7-4-8-13(16)11(12)9-14(17)10-5-2-1-3-6-10/h1-8,14H,9,17H2
InChIKeySUPBSQOBQDGTOE-UHFFFAOYSA-N
XLogP4.24
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.17
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,6-dichlorophenyl)-1-(4-ethylphenyl)ethanamine
CID 63412435
2-(2,6-dichlorophenyl)-1-(3,5-dimethylphenyl)ethanamine
CID 63414806
2-(2,6-dichlorophenyl)-1-pyrimidin-5-ylethanamine
CID 55078463
1-(3,5-dibromophenyl)-2-(2,6-dichlorophenyl)ethanamine
CID 107974218
2-(2,6-dichlorophenyl)-1-(3,4-difluorophenyl)ethanamine
CID 62600681
2-(2,6-dichlorophenyl)-1-(5-methylthiophen-3-yl)ethanamine
CID 65104969
1-(4-bromo-3,5-dimethylphenyl)-2-(2,6-dichlorophenyl)ethanamine
CID 114330130
2-(2,6-dichlorophenyl)-1-(6-methyl-3-pyridinyl)ethanamine
CID 63155828
2-(2,6-dichlorophenyl)-1-(3-fluoro-5-methylphenyl)ethanamine
CID 79704202
2-(2,6-dichlorophenyl)-1-pyrimidin-2-ylethanamine
CID 62602413
2-(4-chlorophenyl)-1-phenylethanamine;hydrochloride
CID 3052629
2-(3-chlorophenyl)-1-phenylethanamine;hydrochloride
CID 3052534

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenyl)-1-phenylethanamine?
The IUPAC name of 2-(2,6-dichlorophenyl)-1-phenylethanamine (CID 55133818) is 2-(2,6-dichlorophenyl)-1-phenylethanamine.
What is the SMILES notation for 2-(2,6-dichlorophenyl)-1-phenylethanamine?
The canonical SMILES for 2-(2,6-dichlorophenyl)-1-phenylethanamine is NC(Cc1c(Cl)cccc1Cl)c1ccccc1.
What is the InChIKey of 2-(2,6-dichlorophenyl)-1-phenylethanamine?
The InChIKey is SUPBSQOBQDGTOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2N/c15-12-7-4-8-13(16)11(12)9-14(17)10-5-2-1-3-6-10/h1-8,14H,9,17H2.
What are the key properties of 2-(2,6-dichlorophenyl)-1-phenylethanamine?
2-(2,6-dichlorophenyl)-1-phenylethanamine has a molecular weight of 266.17 g/mol, XLogP of 4.24, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenyl)-1-phenylethanamine is sourced from PubChem (CID 55133818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).