(4-chloro-6-methyl-2-pyridinyl)methanamine

C7H9ClN2 — CID 55253198

IUPAC(4-chloro-6-methyl-2-pyridinyl)methanamine
SMILESCc1cc(Cl)cc(CN)n1
InChIInChI=1S/C7H9ClN2/c1-5-2-6(8)3-7(4-9)10-5/h2-3H,4,9H2,1H3
InChIKeySPUPHJSEXARGJV-UHFFFAOYSA-N
MW156.62 g/mol
LogP1.50
Rot. Bonds1

About (4-chloro-6-methyl-2-pyridinyl)methanamine

(4-chloro-6-methyl-2-pyridinyl)methanamine (PubChem CID 55253198) has the molecular formula C7H9ClN2 and a molecular weight of 156.62 g/mol. Its IUPAC name is (4-chloro-6-methyl-2-pyridinyl)methanamine.

Molecular Properties

Compound Name(4-chloro-6-methyl-2-pyridinyl)methanamine
PubChem CID55253198
Molecular FormulaC7H9ClN2
Molecular Weight156.62 g/mol
Exact Mass156.05
IUPAC Name(4-chloro-6-methyl-2-pyridinyl)methanamine
SMILESCc1cc(Cl)cc(CN)n1
InChIInChI=1S/C7H9ClN2/c1-5-2-6(8)3-7(4-9)10-5/h2-3H,4,9H2,1H3
InChIKeySPUPHJSEXARGJV-UHFFFAOYSA-N
XLogP1.50
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.62
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-chloro-6-methyl-2-pyridinyl)methanamine?
The IUPAC name of (4-chloro-6-methyl-2-pyridinyl)methanamine (CID 55253198) is (4-chloro-6-methyl-2-pyridinyl)methanamine.
What is the SMILES notation for (4-chloro-6-methyl-2-pyridinyl)methanamine?
The canonical SMILES for (4-chloro-6-methyl-2-pyridinyl)methanamine is Cc1cc(Cl)cc(CN)n1.
What is the InChIKey of (4-chloro-6-methyl-2-pyridinyl)methanamine?
The InChIKey is SPUPHJSEXARGJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9ClN2/c1-5-2-6(8)3-7(4-9)10-5/h2-3H,4,9H2,1H3.
What are the key properties of (4-chloro-6-methyl-2-pyridinyl)methanamine?
(4-chloro-6-methyl-2-pyridinyl)methanamine has a molecular weight of 156.62 g/mol, XLogP of 1.50, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chloro-6-methyl-2-pyridinyl)methanamine is sourced from PubChem (CID 55253198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).