pyridin-3-amine

C5H6N2 — CID 10009

IUPACpyridin-3-amine
SMILESNc1cccnc1
InChIInChI=1S/C5H6N2/c6-5-2-1-3-7-4-5/h1-4H,6H2
InChIKeyCUYKNJBYIJFRCU-UHFFFAOYSA-N
MW94.12 g/mol
LogP0.66
Rot. Bonds

About pyridin-3-amine

pyridin-3-amine (PubChem CID 10009) has the molecular formula C5H6N2 and a molecular weight of 94.12 g/mol. Its IUPAC name is pyridin-3-amine.

Molecular Properties

Compound Namepyridin-3-amine
PubChem CID10009
Molecular FormulaC5H6N2
Molecular Weight94.12 g/mol
Exact Mass94.05
IUPAC Namepyridin-3-amine
SMILESNc1cccnc1
InChIInChI=1S/C5H6N2/c6-5-2-1-3-7-4-5/h1-4H,6H2
InChIKeyCUYKNJBYIJFRCU-UHFFFAOYSA-N
XLogP0.66
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50094.12
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of pyridin-3-amine?
The IUPAC name of pyridin-3-amine (CID 10009) is pyridin-3-amine.
What is the SMILES notation for pyridin-3-amine?
The canonical SMILES for pyridin-3-amine is Nc1cccnc1.
What is the InChIKey of pyridin-3-amine?
The InChIKey is CUYKNJBYIJFRCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N2/c6-5-2-1-3-7-4-5/h1-4H,6H2.
What are the key properties of pyridin-3-amine?
pyridin-3-amine has a molecular weight of 94.12 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridin-3-amine is sourced from PubChem (CID 10009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).