4-methylidene-1H-pyridine

C6H7N — CID 6100702

IUPAC4-methylidene-1H-pyridine
SMILESC=C1C=CNC=C1
InChIInChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5,7H,1H2
InChIKeyLNHUKRYPMYSIQT-UHFFFAOYSA-N
MW93.13 g/mol
LogP1.17
Rot. Bonds

About 4-methylidene-1H-pyridine

4-methylidene-1H-pyridine (PubChem CID 6100702) has the molecular formula C6H7N and a molecular weight of 93.13 g/mol. Its IUPAC name is 4-methylidene-1H-pyridine.

Molecular Properties

Compound Name4-methylidene-1H-pyridine
PubChem CID6100702
Molecular FormulaC6H7N
Molecular Weight93.13 g/mol
Exact Mass93.06
IUPAC Name4-methylidene-1H-pyridine
SMILESC=C1C=CNC=C1
InChIInChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5,7H,1H2
InChIKeyLNHUKRYPMYSIQT-UHFFFAOYSA-N
XLogP1.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.13
LogP ≤ 51.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-methylidene-1H-pyridine?
The IUPAC name of 4-methylidene-1H-pyridine (CID 6100702) is 4-methylidene-1H-pyridine.
What is the SMILES notation for 4-methylidene-1H-pyridine?
The canonical SMILES for 4-methylidene-1H-pyridine is C=C1C=CNC=C1.
What is the InChIKey of 4-methylidene-1H-pyridine?
The InChIKey is LNHUKRYPMYSIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5,7H,1H2.
What are the key properties of 4-methylidene-1H-pyridine?
4-methylidene-1H-pyridine has a molecular weight of 93.13 g/mol, XLogP of 1.17, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methylidene-1H-pyridine is sourced from PubChem (CID 6100702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).