6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine

C15H17ClN2O — CID 79239525

IUPAC6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(COCc2ccccc2Cl)n1
InChIInChI=1S/C15H17ClN2O/c1-2-17-15-9-5-7-13(18-15)11-19-10-12-6-3-4-8-14(12)16/h3-9H,2,10-11H2,1H3,(H,17,18)
InChIKeyWMERVAIFAZQKRC-UHFFFAOYSA-N
MW276.77 g/mol
LogP3.88
Rot. Bonds6

About 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine

6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine (PubChem CID 79239525) has the molecular formula C15H17ClN2O and a molecular weight of 276.77 g/mol. Its IUPAC name is 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine.

Molecular Properties

Compound Name6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine
PubChem CID79239525
Molecular FormulaC15H17ClN2O
Molecular Weight276.77 g/mol
Exact Mass276.10
IUPAC Name6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine
SMILESCCNc1cccc(COCc2ccccc2Cl)n1
InChIInChI=1S/C15H17ClN2O/c1-2-17-15-9-5-7-13(18-15)11-19-10-12-6-3-4-8-14(12)16/h3-9H,2,10-11H2,1H3,(H,17,18)
InChIKeyWMERVAIFAZQKRC-UHFFFAOYSA-N
XLogP3.88
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.77
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine?
The IUPAC name of 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine (CID 79239525) is 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine.
What is the SMILES notation for 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine?
The canonical SMILES for 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine is CCNc1cccc(COCc2ccccc2Cl)n1.
What is the InChIKey of 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine?
The InChIKey is WMERVAIFAZQKRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN2O/c1-2-17-15-9-5-7-13(18-15)11-19-10-12-6-3-4-8-14(12)16/h3-9H,2,10-11H2,1H3,(H,17,18).
What are the key properties of 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine?
6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine has a molecular weight of 276.77 g/mol, XLogP of 3.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(2-chlorophenyl)methoxymethyl]-N-ethylpyridin-2-amine is sourced from PubChem (CID 79239525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).