2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine

C16H17Cl2NO — CID 105099609

IUPAC2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine
SMILESCNC(c1ccccc1Cl)C(C)Oc1cccc(Cl)c1
InChIInChI=1S/C16H17Cl2NO/c1-11(20-13-7-5-6-12(17)10-13)16(19-2)14-8-3-4-9-15(14)18/h3-11,16,19H,1-2H3
InChIKeyHAJJZGSEPCIESS-UHFFFAOYSA-N
MW310.22 g/mol
LogP4.72
Rot. Bonds5

About 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine

2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine (PubChem CID 105099609) has the molecular formula C16H17Cl2NO and a molecular weight of 310.22 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine
PubChem CID105099609
Molecular FormulaC16H17Cl2NO
Molecular Weight310.22 g/mol
Exact Mass309.07
IUPAC Name2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine
SMILESCNC(c1ccccc1Cl)C(C)Oc1cccc(Cl)c1
InChIInChI=1S/C16H17Cl2NO/c1-11(20-13-7-5-6-12(17)10-13)16(19-2)14-8-3-4-9-15(14)18/h3-11,16,19H,1-2H3
InChIKeyHAJJZGSEPCIESS-UHFFFAOYSA-N
XLogP4.72
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.22
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-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-(2-chloro-5-fluorophenyl)-2-(3-chlorophenoxy)-N-methylpropan-1-amine
CID 105397219
[2-(3-chlorophenoxy)-1-(2-methoxyphenyl)propyl]hydrazine
CID 105285682
2-(3-chlorophenoxy)-1-(3-fluoro-4-methylphenyl)-N-methylpropan-1-amine
CID 107130479
2-(3-chlorophenoxy)-N-methylhex-5-en-3-amine
CID 105108066
[2-(3-chlorophenoxy)-1-(2,3-difluorophenyl)propyl]hydrazine
CID 105309301
2-(3-chlorophenoxy)-1-(2-methylphenyl)propan-1-amine
CID 105094671
[1-(3-chloro-4-methylphenyl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 107562651
[2-(3-chlorophenoxy)-1-(2,4-difluorophenyl)propyl]hydrazine
CID 105303167
1-(4-bromo-1-ethylpyrazol-5-yl)-2-(3-chlorophenoxy)-N-methylpropan-1-amine
CID 105182888
[1-(3-bromo-2-fluorophenyl)-2-(3-chlorophenoxy)propyl]hydrazine
CID 106649782
2-(3-chlorophenoxy)-1-(2-fluorophenyl)propan-1-ol
CID 105083853
2-(3-chlorophenoxy)-1-(2-methoxyphenyl)propan-1-amine
CID 105093487

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine?
The IUPAC name of 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine (CID 105099609) is 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine.
What is the SMILES notation for 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine?
The canonical SMILES for 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine is CNC(c1ccccc1Cl)C(C)Oc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine?
The InChIKey is HAJJZGSEPCIESS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17Cl2NO/c1-11(20-13-7-5-6-12(17)10-13)16(19-2)14-8-3-4-9-15(14)18/h3-11,16,19H,1-2H3.
What are the key properties of 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine?
2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine has a molecular weight of 310.22 g/mol, XLogP of 4.72, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-1-(2-chlorophenyl)-N-methylpropan-1-amine is sourced from PubChem (CID 105099609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).