1H-pyridine

C5H5N — CID 12639442

IUPAC1H-pyridine
SMILESC1=CC=CNC=1
InChIInChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-2,4-6H
InChIKeyWWAZWIDQCPNPBD-UHFFFAOYSA-N
MW79.10 g/mol
LogP0.77
Rot. Bonds

About 1H-pyridine

1H-pyridine (PubChem CID 12639442) has the molecular formula C5H5N and a molecular weight of 79.10 g/mol. Its IUPAC name is 1H-pyridine.

Molecular Properties

Compound Name1H-pyridine
PubChem CID12639442
Molecular FormulaC5H5N
Molecular Weight79.10 g/mol
Exact Mass79.04
IUPAC Name1H-pyridine
SMILESC1=CC=CNC=1
InChIInChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-2,4-6H
InChIKeyWWAZWIDQCPNPBD-UHFFFAOYSA-N
XLogP0.77
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50079.10
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-pyridine?
The IUPAC name of 1H-pyridine (CID 12639442) is 1H-pyridine.
What is the SMILES notation for 1H-pyridine?
The canonical SMILES for 1H-pyridine is C1=CC=CNC=1.
What is the InChIKey of 1H-pyridine?
The InChIKey is WWAZWIDQCPNPBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-2,4-6H.
What are the key properties of 1H-pyridine?
1H-pyridine has a molecular weight of 79.10 g/mol, XLogP of 0.77, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-pyridine is sourced from PubChem (CID 12639442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).