N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine

C14H15ClN2O — CID 62295900

IUPACN-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(Oc2ccccc2Cl)n1
InChIInChI=1S/C14H15ClN2O/c1-2-16-10-11-6-5-9-14(17-11)18-13-8-4-3-7-12(13)15/h3-9,16H,2,10H2,1H3
InChIKeyWGXKDEKVORRHAA-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.64
Rot. Bonds5

About N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine

N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine (PubChem CID 62295900) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
PubChem CID62295900
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC NameN-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
SMILESCCNCc1cccc(Oc2ccccc2Cl)n1
InChIInChI=1S/C14H15ClN2O/c1-2-16-10-11-6-5-9-14(17-11)18-13-8-4-3-7-12(13)15/h3-9,16H,2,10H2,1H3
InChIKeyWGXKDEKVORRHAA-UHFFFAOYSA-N
XLogP3.64
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-(2-methylsulfanylphenoxy)-2-pyridinyl]methyl]ethanamine
CID 63647535
N-[[6-(2-prop-1-enylphenoxy)-2-pyridinyl]methyl]ethanamine
CID 76938437
N-[[2-chloro-6-(2-chlorophenoxy)phenyl]methyl]ethanamine
CID 43282972
N-[[6-(3-chlorophenoxy)-2-pyridinyl]methyl]ethanamine
CID 62323929
1-[6-(2,3-dichlorophenoxy)-2-pyridinyl]-N-methylmethanamine
CID 62296347
N-[[5-(2,3-dichlorophenoxy)pyrazin-2-yl]methyl]ethanamine
CID 107381649
N-[[6-(3-chloro-4-fluorophenoxy)-2-pyridinyl]methyl]ethanamine
CID 55257457
N-[[2-(2-chlorophenoxy)-4-pyridinyl]methyl]ethanamine
CID 62297828
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]ethanamine
CID 11566567
N-[(6-chloro-2-pyridinyl)methyl]ethanamine
CID 119090911
N-[[6-[(2-methylpropan-2-yl)oxy]-2-pyridinyl]methyl]ethanamine
CID 62290561
4-chloro-2-[6-(2-chlorophenoxy)-2-pyridinyl]-6-propylpyrimidine
CID 14458719

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine?
The IUPAC name of N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine (CID 62295900) is N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine.
What is the SMILES notation for N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine?
The canonical SMILES for N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine is CCNCc1cccc(Oc2ccccc2Cl)n1.
What is the InChIKey of N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine?
The InChIKey is WGXKDEKVORRHAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-2-16-10-11-6-5-9-14(17-11)18-13-8-4-3-7-12(13)15/h3-9,16H,2,10H2,1H3.
What are the key properties of N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine?
N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine has a molecular weight of 262.74 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-chlorophenoxy)-2-pyridinyl]methyl]ethanamine is sourced from PubChem (CID 62295900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).