1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine

C15H15Cl2N — CID 60818995

IUPAC1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(Cl)cc1)c1cccc(Cl)c1
InChIInChI=1S/C15H15Cl2N/c1-18-15(12-3-2-4-14(17)10-12)9-11-5-7-13(16)8-6-11/h2-8,10,15,18H,9H2,1H3
InChIKeyRRTAVSPIYXWXFH-UHFFFAOYSA-N
MW280.20 g/mol
LogP4.50
Rot. Bonds4

About 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine

1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine (PubChem CID 60818995) has the molecular formula C15H15Cl2N and a molecular weight of 280.20 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine
PubChem CID60818995
Molecular FormulaC15H15Cl2N
Molecular Weight280.20 g/mol
Exact Mass279.06
IUPAC Name1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine
SMILESCNC(Cc1ccc(Cl)cc1)c1cccc(Cl)c1
InChIInChI=1S/C15H15Cl2N/c1-18-15(12-3-2-4-14(17)10-12)9-11-5-7-13(16)8-6-11/h2-8,10,15,18H,9H2,1H3
InChIKeyRRTAVSPIYXWXFH-UHFFFAOYSA-N
XLogP4.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.20
LogP ≤ 54.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(3-chlorophenyl)-N-methyl-2-(4-propan-2-ylphenyl)ethanamine
CID 63411987
1-(3-bromophenyl)-2-(4-chlorophenyl)-N-methylethanamine
CID 60818143
1-(3-chlorophenyl)-N-methyl-2-(4-nitrophenyl)ethanamine
CID 61064647
1-[1-(3-chlorophenyl)-2-(4-chlorophenyl)ethyl]-2-ethylhydrazine
CID 91267468
2-(4-chlorophenyl)-1-[3-(difluoromethoxy)phenyl]-N-methylethanamine
CID 61065024
2-(4-chlorophenyl)-1-(3,4-dichlorophenyl)-N-methylethanamine
CID 43486451
2-(3-chlorophenyl)-1-(3-ethoxyphenyl)-N-methylethanamine
CID 60818609
1-(3,5-dichlorophenyl)-N-methyl-2-(4-methylphenyl)ethanamine
CID 63526721
1-(3-chlorophenyl)-3-(4-chlorophenyl)-N-methylpropan-2-amine
CID 60820361
N-methyl-1-(3-methylphenyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 63413558
2-(3-chlorophenyl)-N-methyl-1-naphthalen-2-ylethanamine
CID 63412161
2-(4-bromo-2-fluorophenyl)-1-(3-chlorophenyl)-N-methylethanamine
CID 55186986

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine?
The IUPAC name of 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine (CID 60818995) is 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine.
What is the SMILES notation for 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine?
The canonical SMILES for 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine is CNC(Cc1ccc(Cl)cc1)c1cccc(Cl)c1.
What is the InChIKey of 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine?
The InChIKey is RRTAVSPIYXWXFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2N/c1-18-15(12-3-2-4-14(17)10-12)9-11-5-7-13(16)8-6-11/h2-8,10,15,18H,9H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine?
1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine has a molecular weight of 280.20 g/mol, XLogP of 4.50, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-2-(4-chlorophenyl)-N-methylethanamine is sourced from PubChem (CID 60818995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).