5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine

C16H19ClN2O — CID 63484940

IUPAC5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(COc2cc(C)ccc2C)n1
InChIInChI=1S/C16H19ClN2O/c1-4-18-16-8-7-13(17)14(19-16)10-20-15-9-11(2)5-6-12(15)3/h5-9H,4,10H2,1-3H3,(H,18,19)
InChIKeyBMXHGRPUQPQAET-UHFFFAOYSA-N
MW290.79 g/mol
LogP4.36
Rot. Bonds5

About 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine

5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine (PubChem CID 63484940) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine
PubChem CID63484940
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC Name5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine
SMILESCCNc1ccc(Cl)c(COc2cc(C)ccc2C)n1
InChIInChI=1S/C16H19ClN2O/c1-4-18-16-8-7-13(17)14(19-16)10-20-15-9-11(2)5-6-12(15)3/h5-9H,4,10H2,1-3H3,(H,18,19)
InChIKeyBMXHGRPUQPQAET-UHFFFAOYSA-N
XLogP4.36
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-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

5-chloro-N-ethyl-6-[(2,3,5-trimethylphenoxy)methyl]pyridin-2-amine
CID 63484955
6-[(4-bromo-2-fluorophenoxy)methyl]-5-chloro-N-ethylpyridin-2-amine
CID 63485322
5-chloro-N-ethyl-6-[(2-methylsulfanylphenoxy)methyl]pyridin-2-amine
CID 63649715
5-chloro-6-[(2-chloro-4-fluorophenoxy)methyl]-N-propylpyridin-2-amine
CID 63486695
5-chloro-6-[(2,6-dibromophenoxy)methyl]-N-ethylpyridin-2-amine
CID 63485313
4-[(2-chloro-5-methylphenoxy)methyl]-N-ethylpyridin-2-amine
CID 62466198
5-[(2-chloro-4-methylphenoxy)methyl]-N-ethylpyrazin-2-amine
CID 103059015
5-chloro-6-[(2,5-difluorophenoxy)methyl]-N-propylpyridin-2-amine
CID 63273486
N-[[3-chloro-6-(2,5-dimethylphenoxy)-2-pyridinyl]methyl]ethanamine
CID 62297317
5-chloro-6-(2,2-difluoroethoxymethyl)-N-ethylpyridin-2-amine
CID 82005693
3-[(3,6-dichloro-2-pyridinyl)methoxy]-4-methylbenzonitrile
CID 104693556
6-(2-chloro-5-methylphenoxy)-N-ethyl-2-propylpyrimidin-4-amine
CID 80942643

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine?
The IUPAC name of 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine (CID 63484940) is 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine is CCNc1ccc(Cl)c(COc2cc(C)ccc2C)n1.
What is the InChIKey of 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine?
The InChIKey is BMXHGRPUQPQAET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-4-18-16-8-7-13(17)14(19-16)10-20-15-9-11(2)5-6-12(15)3/h5-9H,4,10H2,1-3H3,(H,18,19).
What are the key properties of 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine?
5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine has a molecular weight of 290.79 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-6-[(2,5-dimethylphenoxy)methyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 63484940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).