2-propan-2-yl-6-pyridin-3-ylpyridine

C13H14N2 — CID 118124535

IUPAC2-propan-2-yl-6-pyridin-3-ylpyridine
SMILESCC(C)c1cccc(-c2cccnc2)n1
InChIInChI=1S/C13H14N2/c1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11/h3-10H,1-2H3
InChIKeyUJXCXYFSHUSHKH-UHFFFAOYSA-N
MW198.27 g/mol
LogP3.27
Rot. Bonds2

About 2-propan-2-yl-6-pyridin-3-ylpyridine

2-propan-2-yl-6-pyridin-3-ylpyridine (PubChem CID 118124535) has the molecular formula C13H14N2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 2-propan-2-yl-6-pyridin-3-ylpyridine.

Molecular Properties

Compound Name2-propan-2-yl-6-pyridin-3-ylpyridine
PubChem CID118124535
Molecular FormulaC13H14N2
Molecular Weight198.27 g/mol
Exact Mass198.12
IUPAC Name2-propan-2-yl-6-pyridin-3-ylpyridine
SMILESCC(C)c1cccc(-c2cccnc2)n1
InChIInChI=1S/C13H14N2/c1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11/h3-10H,1-2H3
InChIKeyUJXCXYFSHUSHKH-UHFFFAOYSA-N
XLogP3.27
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-propan-2-yl-6-pyridin-3-ylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,6-dipyridin-3-ylpyridine
CID 13349632
ethane;2-methyl-6-pyridin-3-ylpyridine
CID 144687863
2-[3,5-bis[6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]phenyl]-6-[6-(6-pyridin-3-yl-2-pyridinyl)-2-pyridinyl]pyridine
CID 58090487
2-(3-methylphenyl)-6-propan-2-ylpyridine
CID 142459956
bis(2-methylpropane);3-pyridin-3-ylpyridine
CID 158581875
2-methyl-6-pyridin-3-ylpyridine;propane
CID 144615785
8-methyl-2-pyridin-3-ylquinoline
CID 125496977
2-phenoxy-6-[1-(6-pyridin-3-yl-2-pyridinyl)propan-2-yl]pyridine
CID 58106766
4-propan-2-yl-2-pyridin-2-yl-6-pyridin-3-ylpyridine
CID 59246459
cyclopenta[c]azepine
CID 638010
2-pyridin-3-yl-5,6,7,8-tetrahydroquinoline
CID 59083928
2-bromo-3-ethyl-6-pyridin-3-ylpyridine
CID 175213235

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yl-6-pyridin-3-ylpyridine?
The IUPAC name of 2-propan-2-yl-6-pyridin-3-ylpyridine (CID 118124535) is 2-propan-2-yl-6-pyridin-3-ylpyridine.
What is the SMILES notation for 2-propan-2-yl-6-pyridin-3-ylpyridine?
The canonical SMILES for 2-propan-2-yl-6-pyridin-3-ylpyridine is CC(C)c1cccc(-c2cccnc2)n1.
What is the InChIKey of 2-propan-2-yl-6-pyridin-3-ylpyridine?
The InChIKey is UJXCXYFSHUSHKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2/c1-10(2)12-6-3-7-13(15-12)11-5-4-8-14-9-11/h3-10H,1-2H3.
What are the key properties of 2-propan-2-yl-6-pyridin-3-ylpyridine?
2-propan-2-yl-6-pyridin-3-ylpyridine has a molecular weight of 198.27 g/mol, XLogP of 3.27, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yl-6-pyridin-3-ylpyridine is sourced from PubChem (CID 118124535), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).