5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine

C13H18N2 — CID 176586744

IUPAC5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
SMILESCC(C)c1ccc(C2=CCCNC2)nc1
InChIInChI=1S/C13H18N2/c1-10(2)11-5-6-13(15-9-11)12-4-3-7-14-8-12/h4-6,9-10,14H,3,7-8H2,1-2H3
InChIKeyZMXRVEHVBDPEDG-UHFFFAOYSA-N
MW202.30 g/mol
LogP2.58
Rot. Bonds2

About 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine

5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine (PubChem CID 176586744) has the molecular formula C13H18N2 and a molecular weight of 202.30 g/mol. Its IUPAC name is 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine.

Molecular Properties

Compound Name5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
PubChem CID176586744
Molecular FormulaC13H18N2
Molecular Weight202.30 g/mol
Exact Mass202.15
IUPAC Name5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
SMILESCC(C)c1ccc(C2=CCCNC2)nc1
InChIInChI=1S/C13H18N2/c1-10(2)11-5-6-13(15-9-11)12-4-3-7-14-8-12/h4-6,9-10,14H,3,7-8H2,1-2H3
InChIKeyZMXRVEHVBDPEDG-UHFFFAOYSA-N
XLogP2.58
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.30
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

formic acid;2-(1,2,3,6-tetrahydropyridin-5-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 171679952
1-[(5-propan-2-yl-2-pyridinyl)methyl]piperazine
CID 138459736
2-(2-methyltetrazol-5-yl)-5-propan-2-ylpyridine
CID 130333119
2-bromo-5-(1-propan-2-yl-3,6-dihydro-2H-pyridin-5-yl)pyridine;2-bromo-5-(1,2,3,6-tetrahydropyridin-5-yl)pyridine;2-iodopropane
CID 160905602
1-phenyl-3-(1,2,3,6-tetrahydropyridin-5-yl)isoquinoline
CID 3021935
2-(phenylsulfanylmethyl)-6-(1,2,3,6-tetrahydropyridin-5-yl)pyridine
CID 66612778
5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-thiazole;hydrochloride
CID 154803645
2-[5-(2,2-dimethylpropyl)-1H-pyrazol-3-yl]-5-propan-2-ylpyridine
CID 90268917
3-methyl-5-(5-propan-2-yl-2-pyridinyl)-1,2-oxazole
CID 176864957
4-(5-propan-2-yl-2-pyridinyl)morpholine
CID 20750181
7-(5-propan-2-yl-2-pyridinyl)pyrrolo[2,1-f][1,2,4]triazin-2-amine
CID 169117399
2-piperazin-1-yl-5-propan-2-ylpyrimidine
CID 103278323

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The IUPAC name of 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine (CID 176586744) is 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine.
What is the SMILES notation for 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The canonical SMILES for 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine is CC(C)c1ccc(C2=CCCNC2)nc1.
What is the InChIKey of 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
The InChIKey is ZMXRVEHVBDPEDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2/c1-10(2)11-5-6-13(15-9-11)12-4-3-7-14-8-12/h4-6,9-10,14H,3,7-8H2,1-2H3.
What are the key properties of 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine?
5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine has a molecular weight of 202.30 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-2-(1,2,3,6-tetrahydropyridin-5-yl)pyridine is sourced from PubChem (CID 176586744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).