1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine

C14H13Cl2NO — CID 43282384

IUPAC1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-17-9-10-5-2-3-7-12(10)18-13-8-4-6-11(15)14(13)16/h2-8,17H,9H2,1H3
InChIKeyBKFUIBVLFKGQLG-UHFFFAOYSA-N
MW282.17 g/mol
LogP4.51
Rot. Bonds4

About 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine

1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine (PubChem CID 43282384) has the molecular formula C14H13Cl2NO and a molecular weight of 282.17 g/mol. Its IUPAC name is 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
PubChem CID43282384
Molecular FormulaC14H13Cl2NO
Molecular Weight282.17 g/mol
Exact Mass281.04
IUPAC Name1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine
SMILESCNCc1ccccc1Oc1cccc(Cl)c1Cl
InChIInChI=1S/C14H13Cl2NO/c1-17-9-10-5-2-3-7-12(10)18-13-8-4-6-11(15)14(13)16/h2-8,17H,9H2,1H3
InChIKeyBKFUIBVLFKGQLG-UHFFFAOYSA-N
XLogP4.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.17
LogP ≤ 54.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine 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-(2-ethylphenoxy)phenyl]-N-methylmethanamine
CID 43283795
1-[2-(2,6-dimethylphenoxy)phenyl]-N-methylmethanamine
CID 43282630
N'-[[2-(2,3-dichlorophenoxy)phenyl]methyl]-N,N'-dimethylethane-1,2-diamine;hydrochloride
CID 170453249
1-[6-(2,3-dichlorophenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62296347
1-[2-(5-chloropyrimidin-4-yl)oxyphenyl]-N-methylmethanamine
CID 106485504
1-[2-[(5-chloro-2-pyridinyl)oxy]phenyl]-N-methylmethanamine
CID 106485445
N-methyl-1-[2-[2-(trifluoromethyl)phenoxy]phenyl]methanamine
CID 43282524
1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62297929
1-[2-chloro-6-(2-iodophenoxy)phenyl]-N-methylmethanamine
CID 43479857
1-[5-chloro-2-(2-ethylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 114928464
1,2-dichloro-3-(2,6-dichlorophenoxy)benzene
CID 72941859
N-[[3-(2,3-dichlorophenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 105075167

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine (CID 43282384) is 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine is CNCc1ccccc1Oc1cccc(Cl)c1Cl.
What is the InChIKey of 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine?
The InChIKey is BKFUIBVLFKGQLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13Cl2NO/c1-17-9-10-5-2-3-7-12(10)18-13-8-4-6-11(15)14(13)16/h2-8,17H,9H2,1H3.
What are the key properties of 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine?
1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine has a molecular weight of 282.17 g/mol, XLogP of 4.51, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,3-dichlorophenoxy)phenyl]-N-methylmethanamine is sourced from PubChem (CID 43282384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).