pyridin-2-ylmethanamine

C6H8N2 — CID 19509

IUPACpyridin-2-ylmethanamine
SMILESNCc1ccccn1
InChIInChI=1S/C6H8N2/c7-5-6-3-1-2-4-8-6/h1-4H,5,7H2
InChIKeyWOXFMYVTSLAQMO-UHFFFAOYSA-N
MW108.14 g/mol
LogP0.54
Rot. Bonds1

About pyridin-2-ylmethanamine

pyridin-2-ylmethanamine (PubChem CID 19509) has the molecular formula C6H8N2 and a molecular weight of 108.14 g/mol. Its IUPAC name is pyridin-2-ylmethanamine.

Molecular Properties

Compound Namepyridin-2-ylmethanamine
PubChem CID19509
Molecular FormulaC6H8N2
Molecular Weight108.14 g/mol
Exact Mass108.07
IUPAC Namepyridin-2-ylmethanamine
SMILESNCc1ccccn1
InChIInChI=1S/C6H8N2/c7-5-6-3-1-2-4-8-6/h1-4H,5,7H2
InChIKeyWOXFMYVTSLAQMO-UHFFFAOYSA-N
XLogP0.54
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500108.14
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Pyridine
CID 1049
4-Aminopyridine
CID 1727
Ethionamide
CID 2761171
2,2'-Bipyridine
CID 1474
Pralidoxime Chloride
CID 135445761
2-Methylpyridine
CID 7975
3,4-Diaminopyridine
CID 5918
Myosmine
CID 442649
2-Vinylpyridine
CID 7521
Betahistine
CID 2366
2-Pyridineethanamine
CID 75919
5-Ethyl-2-methylpyridine
CID 7728

Frequently Asked Questions

What is the IUPAC name of pyridin-2-ylmethanamine?
The IUPAC name of pyridin-2-ylmethanamine (CID 19509) is pyridin-2-ylmethanamine.
What is the SMILES notation for pyridin-2-ylmethanamine?
The canonical SMILES for pyridin-2-ylmethanamine is NCc1ccccn1.
What is the InChIKey of pyridin-2-ylmethanamine?
The InChIKey is WOXFMYVTSLAQMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8N2/c7-5-6-3-1-2-4-8-6/h1-4H,5,7H2.
What are the key properties of pyridin-2-ylmethanamine?
pyridin-2-ylmethanamine has a molecular weight of 108.14 g/mol, XLogP of 0.54, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-2-ylmethanamine is sourced from PubChem (CID 19509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).