5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine

C14H14ClFN2O — CID 63937581

IUPAC5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine
SMILESCNc1ccc(Cl)c(COCc2ccccc2F)n1
InChIInChI=1S/C14H14ClFN2O/c1-17-14-7-6-11(15)13(18-14)9-19-8-10-4-2-3-5-12(10)16/h2-7H,8-9H2,1H3,(H,17,18)
InChIKeyJSDOHSVCAUKSGT-UHFFFAOYSA-N
MW280.73 g/mol
LogP3.63
Rot. Bonds5

About 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine

5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine (PubChem CID 63937581) has the molecular formula C14H14ClFN2O and a molecular weight of 280.73 g/mol. Its IUPAC name is 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine
PubChem CID63937581
Molecular FormulaC14H14ClFN2O
Molecular Weight280.73 g/mol
Exact Mass280.08
IUPAC Name5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine
SMILESCNc1ccc(Cl)c(COCc2ccccc2F)n1
InChIInChI=1S/C14H14ClFN2O/c1-17-14-7-6-11(15)13(18-14)9-19-8-10-4-2-3-5-12(10)16/h2-7H,8-9H2,1H3,(H,17,18)
InChIKeyJSDOHSVCAUKSGT-UHFFFAOYSA-N
XLogP3.63
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine?
The IUPAC name of 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine (CID 63937581) is 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine is CNc1ccc(Cl)c(COCc2ccccc2F)n1.
What is the InChIKey of 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine?
The InChIKey is JSDOHSVCAUKSGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14ClFN2O/c1-17-14-7-6-11(15)13(18-14)9-19-8-10-4-2-3-5-12(10)16/h2-7H,8-9H2,1H3,(H,17,18).
What are the key properties of 5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine?
5-chloro-6-[(2-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine has a molecular weight of 280.73 g/mol, XLogP of 3.63, 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-fluorophenyl)methoxymethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 63937581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).