5-chloro-1-methylpyridin-2-imine

C6H7ClN2 — CID 134594393

IUPAC5-chloro-1-methylpyridin-2-imine
SMILES[H]/N=c1\ccc(Cl)cn1C
InChIInChI=1S/C6H7ClN2/c1-9-4-5(7)2-3-6(9)8/h2-4,8H,1H3/b8-6+
InChIKeyFPYMNLZHTALCAA-SOFGYWHQSA-N
MW142.59 g/mol
LogP1.16
Rot. Bonds

About 5-chloro-1-methylpyridin-2-imine

5-chloro-1-methylpyridin-2-imine (PubChem CID 134594393) has the molecular formula C6H7ClN2 and a molecular weight of 142.59 g/mol. Its IUPAC name is 5-chloro-1-methylpyridin-2-imine.

Molecular Properties

Compound Name5-chloro-1-methylpyridin-2-imine
PubChem CID134594393
Molecular FormulaC6H7ClN2
Molecular Weight142.59 g/mol
Exact Mass142.03
IUPAC Name5-chloro-1-methylpyridin-2-imine
SMILES[H]/N=c1\ccc(Cl)cn1C
InChIInChI=1S/C6H7ClN2/c1-9-4-5(7)2-3-6(9)8/h2-4,8H,1H3/b8-6+
InChIKeyFPYMNLZHTALCAA-SOFGYWHQSA-N
XLogP1.16
TPSA28.78 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.59
LogP ≤ 51.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-chloro-1-methylpyridin-2-imine?
The IUPAC name of 5-chloro-1-methylpyridin-2-imine (CID 134594393) is 5-chloro-1-methylpyridin-2-imine.
What is the SMILES notation for 5-chloro-1-methylpyridin-2-imine?
The canonical SMILES for 5-chloro-1-methylpyridin-2-imine is [H]/N=c1\ccc(Cl)cn1C.
What is the InChIKey of 5-chloro-1-methylpyridin-2-imine?
The InChIKey is FPYMNLZHTALCAA-SOFGYWHQSA-N. The full InChI is InChI=1S/C6H7ClN2/c1-9-4-5(7)2-3-6(9)8/h2-4,8H,1H3/b8-6+.
What are the key properties of 5-chloro-1-methylpyridin-2-imine?
5-chloro-1-methylpyridin-2-imine has a molecular weight of 142.59 g/mol, XLogP of 1.16, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-1-methylpyridin-2-imine is sourced from PubChem (CID 134594393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).