6-(chloromethyl)-N-methylpyridin-2-amine

C7H9ClN2 — CID 90018350

IUPAC6-(chloromethyl)-N-methylpyridin-2-amine
SMILESCNc1cccc(CCl)n1
InChIInChI=1S/C7H9ClN2/c1-9-7-4-2-3-6(5-8)10-7/h2-4H,5H2,1H3,(H,9,10)
InChIKeyANYWEXNKPJPADR-UHFFFAOYSA-N
MW156.62 g/mol
LogP1.86
Rot. Bonds2

About 6-(chloromethyl)-N-methylpyridin-2-amine

6-(chloromethyl)-N-methylpyridin-2-amine (PubChem CID 90018350) has the molecular formula C7H9ClN2 and a molecular weight of 156.62 g/mol. Its IUPAC name is 6-(chloromethyl)-N-methylpyridin-2-amine.

Molecular Properties

Compound Name6-(chloromethyl)-N-methylpyridin-2-amine
PubChem CID90018350
Molecular FormulaC7H9ClN2
Molecular Weight156.62 g/mol
Exact Mass156.05
IUPAC Name6-(chloromethyl)-N-methylpyridin-2-amine
SMILESCNc1cccc(CCl)n1
InChIInChI=1S/C7H9ClN2/c1-9-7-4-2-3-6(5-8)10-7/h2-4H,5H2,1H3,(H,9,10)
InChIKeyANYWEXNKPJPADR-UHFFFAOYSA-N
XLogP1.86
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.62
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(chloromethyl)-N-methylpyridin-2-amine?
The IUPAC name of 6-(chloromethyl)-N-methylpyridin-2-amine (CID 90018350) is 6-(chloromethyl)-N-methylpyridin-2-amine.
What is the SMILES notation for 6-(chloromethyl)-N-methylpyridin-2-amine?
The canonical SMILES for 6-(chloromethyl)-N-methylpyridin-2-amine is CNc1cccc(CCl)n1.
What is the InChIKey of 6-(chloromethyl)-N-methylpyridin-2-amine?
The InChIKey is ANYWEXNKPJPADR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2/c1-9-7-4-2-3-6(5-8)10-7/h2-4H,5H2,1H3,(H,9,10).
What are the key properties of 6-(chloromethyl)-N-methylpyridin-2-amine?
6-(chloromethyl)-N-methylpyridin-2-amine has a molecular weight of 156.62 g/mol, XLogP of 1.86, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(chloromethyl)-N-methylpyridin-2-amine is sourced from PubChem (CID 90018350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).