6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine

C14H15ClN2O — CID 79238943

IUPAC6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COc2cc(C)ccc2Cl)n1
InChIInChI=1S/C14H15ClN2O/c1-10-6-7-12(15)13(8-10)18-9-11-4-3-5-14(16-2)17-11/h3-8H,9H2,1-2H3,(H,16,17)
InChIKeyXHAPSVTXZNWRJV-UHFFFAOYSA-N
MW262.74 g/mol
LogP3.66
Rot. Bonds4

About 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine

6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine (PubChem CID 79238943) has the molecular formula C14H15ClN2O and a molecular weight of 262.74 g/mol. Its IUPAC name is 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine
PubChem CID79238943
Molecular FormulaC14H15ClN2O
Molecular Weight262.74 g/mol
Exact Mass262.09
IUPAC Name6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine
SMILESCNc1cccc(COc2cc(C)ccc2Cl)n1
InChIInChI=1S/C14H15ClN2O/c1-10-6-7-12(15)13(8-10)18-9-11-4-3-5-14(16-2)17-11/h3-8H,9H2,1-2H3,(H,16,17)
InChIKeyXHAPSVTXZNWRJV-UHFFFAOYSA-N
XLogP3.66
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.74
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[6-[(2-chloro-5-methylphenoxy)methyl]-2-pyridinyl]methyl]ethanamine
CID 106908205
6-[(2-chloro-5-methylphenoxy)methyl]pyridine-2-carbohydrazide
CID 106908889
6-[(2-iodophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239369
6-[(2,4-difluorophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239177
4-methyl-3-[[6-(methylamino)-2-pyridinyl]methoxy]benzonitrile
CID 107660580
[6-[(2,4-dichlorophenoxy)methyl]-2-pyridinyl]hydrazine
CID 79233690
6-[(3-bromophenoxy)methyl]-N-methylpyridin-2-amine
CID 79239184
3-[(2-chloro-5-methylphenoxy)methyl]-1,5-dimethylpyrazole
CID 82087546
1-[6-[(2-bromo-4-methylphenoxy)methyl]-2-pyridinyl]-N-methylmethanamine
CID 106908164
[2-[(2-chloro-5-methylphenoxy)methyl]-4-pyridinyl]hydrazine
CID 79259210
1-[4-[(2-chloro-5-methylphenoxy)methyl]phenyl]-N-methylmethanamine
CID 62485881
2-(chloromethyl)-6-(2-chloro-5-methylphenoxy)pyridine
CID 62239031

Frequently Asked Questions

What is the IUPAC name of 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine?
The IUPAC name of 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine (CID 79238943) is 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine?
The canonical SMILES for 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine is CNc1cccc(COc2cc(C)ccc2Cl)n1.
What is the InChIKey of 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine?
The InChIKey is XHAPSVTXZNWRJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15ClN2O/c1-10-6-7-12(15)13(8-10)18-9-11-4-3-5-14(16-2)17-11/h3-8H,9H2,1-2H3,(H,16,17).
What are the key properties of 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine?
6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine has a molecular weight of 262.74 g/mol, XLogP of 3.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chloro-5-methylphenoxy)methyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 79238943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).