1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine

C13H12Cl2N2O — CID 62297929

IUPAC1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccnc(Oc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C13H12Cl2N2O/c1-16-8-9-5-6-17-12(7-9)18-11-4-2-3-10(14)13(11)15/h2-7,16H,8H2,1H3
InChIKeyMNJBHIIWQSLHCL-UHFFFAOYSA-N
MW283.16 g/mol
LogP3.90
Rot. Bonds4

About 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine

1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine (PubChem CID 62297929) has the molecular formula C13H12Cl2N2O and a molecular weight of 283.16 g/mol. Its IUPAC name is 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
PubChem CID62297929
Molecular FormulaC13H12Cl2N2O
Molecular Weight283.16 g/mol
Exact Mass282.03
IUPAC Name1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine
SMILESCNCc1ccnc(Oc2cccc(Cl)c2Cl)c1
InChIInChI=1S/C13H12Cl2N2O/c1-16-8-9-5-6-17-12(7-9)18-11-4-2-3-10(14)13(11)15/h2-7,16H,8H2,1H3
InChIKeyMNJBHIIWQSLHCL-UHFFFAOYSA-N
XLogP3.90
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.16
LogP ≤ 53.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(2-chlorophenoxy)-4-pyridinyl]-N-methylmethanamine
CID 55058551
N-[[2-(2,3-dichlorophenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 62298107
N-[[2-(2,3-dichlorophenoxy)-4-pyridinyl]methyl]propan-1-amine
CID 62298106
N-[[2-(2-chlorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 62297828
1-[2-(4-chloro-3,5-dimethylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62323652
1-[6-(2,3-dichlorophenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62296347
N-[[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methyl]-2-methylpropan-2-amine
CID 116690064
N-[[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methyl]propan-2-amine
CID 116689984
N-methyl-1-[2-(3-methylphenoxy)-4-pyridinyl]methanamine
CID 55058261
N-[[2-(3-chloro-2-fluorophenoxy)-4-pyridinyl]methyl]-2-methylpropan-1-amine
CID 116689946
1-[2-(3-tert-butylphenoxy)-4-pyridinyl]-N-methylmethanamine
CID 62324004
[2-(2-chlorophenoxy)-4-pyridinyl]methanol
CID 61256084

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine?
The IUPAC name of 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine (CID 62297929) is 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine.
What is the SMILES notation for 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine?
The canonical SMILES for 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine is CNCc1ccnc(Oc2cccc(Cl)c2Cl)c1.
What is the InChIKey of 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine?
The InChIKey is MNJBHIIWQSLHCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12Cl2N2O/c1-16-8-9-5-6-17-12(7-9)18-11-4-2-3-10(14)13(11)15/h2-7,16H,8H2,1H3.
What are the key properties of 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine?
1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine has a molecular weight of 283.16 g/mol, XLogP of 3.90, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,3-dichlorophenoxy)-4-pyridinyl]-N-methylmethanamine is sourced from PubChem (CID 62297929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).