4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine

C11H12N2 — CID 131994161

IUPAC4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine
SMILESCC1=CC=C(c2ccncc2)CN1
InChIInChI=1S/C11H12N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2-7,13H,8H2,1H3
InChIKeyJPFPISSZUUPZAS-UHFFFAOYSA-N
MW172.23 g/mol
LogP1.97
Rot. Bonds1

About 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine

4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine (PubChem CID 131994161) has the molecular formula C11H12N2 and a molecular weight of 172.23 g/mol. Its IUPAC name is 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine.

Molecular Properties

Compound Name4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine
PubChem CID131994161
Molecular FormulaC11H12N2
Molecular Weight172.23 g/mol
Exact Mass172.10
IUPAC Name4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine
SMILESCC1=CC=C(c2ccncc2)CN1
InChIInChI=1S/C11H12N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2-7,13H,8H2,1H3
InChIKeyJPFPISSZUUPZAS-UHFFFAOYSA-N
XLogP1.97
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.23
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine?
The IUPAC name of 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine (CID 131994161) is 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine.
What is the SMILES notation for 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine?
The canonical SMILES for 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine is CC1=CC=C(c2ccncc2)CN1.
What is the InChIKey of 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine?
The InChIKey is JPFPISSZUUPZAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2/c1-9-2-3-11(8-13-9)10-4-6-12-7-5-10/h2-7,13H,8H2,1H3.
What are the key properties of 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine?
4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine has a molecular weight of 172.23 g/mol, XLogP of 1.97, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-methyl-1,2-dihydropyridin-3-yl)pyridine is sourced from PubChem (CID 131994161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).