1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine

C15H15Cl2NO — CID 55022474

IUPAC1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine
SMILESCC(N)C(Oc1ccccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H15Cl2NO/c1-10(18)15(11-6-2-3-7-12(11)16)19-14-9-5-4-8-13(14)17/h2-10,15H,18H2,1H3
InChIKeyBPMWAJNKCUBQEL-UHFFFAOYSA-N
MW296.20 g/mol
LogP4.46
Rot. Bonds4

About 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine

1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine (PubChem CID 55022474) has the molecular formula C15H15Cl2NO and a molecular weight of 296.20 g/mol. Its IUPAC name is 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine.

Molecular Properties

Compound Name1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine
PubChem CID55022474
Molecular FormulaC15H15Cl2NO
Molecular Weight296.20 g/mol
Exact Mass295.05
IUPAC Name1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine
SMILESCC(N)C(Oc1ccccc1Cl)c1ccccc1Cl
InChIInChI=1S/C15H15Cl2NO/c1-10(18)15(11-6-2-3-7-12(11)16)19-14-9-5-4-8-13(14)17/h2-10,15H,18H2,1H3
InChIKeyBPMWAJNKCUBQEL-UHFFFAOYSA-N
XLogP4.46
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.20
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-chlorophenyl)-1-(2-fluoro-3-methylphenoxy)propan-2-amine
CID 107656218
1-(2-chlorophenyl)-1-(4-fluorophenoxy)propan-2-amine
CID 55022666
1-(2-chlorophenyl)-1-(3-fluorophenoxy)propan-2-amine
CID 55022859
1-(2-chlorophenyl)-1-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)propan-2-amine
CID 102721671
1-chloro-2-propan-2-yloxybenzene;ethane
CID 143368114
1-(2-chlorophenyl)-1-(2-iodophenoxy)butan-2-amine
CID 63459761
1-(2-chlorophenyl)-1-cyclopentyloxypropan-2-amine
CID 55022905
1-(2-chlorophenoxy)ethanethiol
CID 147588927
1-(2-chlorophenyl)-1-(2-methylpentoxy)propan-2-amine
CID 103283025
1-(3,5-dichlorophenoxy)-1-(2-methylphenyl)propan-2-amine
CID 63461961
1-(2-chlorophenyl)-1-(cyclohexylmethoxy)propan-2-amine
CID 55066579
3-(2-chlorophenoxy)butan-1-ol
CID 82076432

Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine?
The IUPAC name of 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine (CID 55022474) is 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine.
What is the SMILES notation for 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine?
The canonical SMILES for 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine is CC(N)C(Oc1ccccc1Cl)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine?
The InChIKey is BPMWAJNKCUBQEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Cl2NO/c1-10(18)15(11-6-2-3-7-12(11)16)19-14-9-5-4-8-13(14)17/h2-10,15H,18H2,1H3.
What are the key properties of 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine?
1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine has a molecular weight of 296.20 g/mol, XLogP of 4.46, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenoxy)-1-(2-chlorophenyl)propan-2-amine is sourced from PubChem (CID 55022474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).