2,4,6-tripyridin-2-yl-1,3,5-triazinane

C18H18N6 — CID 3057069

IUPAC2,4,6-tripyridin-2-yl-1,3,5-triazinane
SMILESc1ccc(C2NC(c3ccccn3)NC(c3ccccn3)N2)nc1
InChIInChI=1S/C18H18N6/c1-4-10-19-13(7-1)16-22-17(14-8-2-5-11-20-14)24-18(23-16)15-9-3-6-12-21-15/h1-12,16-18,22-24H
InChIKeyNUSDIQFUHBVDSL-UHFFFAOYSA-N
MW318.38 g/mol
LogP2.05
Rot. Bonds3

About 2,4,6-tripyridin-2-yl-1,3,5-triazinane

2,4,6-tripyridin-2-yl-1,3,5-triazinane (PubChem CID 3057069) has the molecular formula C18H18N6 and a molecular weight of 318.38 g/mol. Its IUPAC name is 2,4,6-tripyridin-2-yl-1,3,5-triazinane.

Molecular Properties

Compound Name2,4,6-tripyridin-2-yl-1,3,5-triazinane
PubChem CID3057069
Molecular FormulaC18H18N6
Molecular Weight318.38 g/mol
Exact Mass318.16
IUPAC Name2,4,6-tripyridin-2-yl-1,3,5-triazinane
SMILESc1ccc(C2NC(c3ccccn3)NC(c3ccccn3)N2)nc1
InChIInChI=1S/C18H18N6/c1-4-10-19-13(7-1)16-22-17(14-8-2-5-11-20-14)24-18(23-16)15-9-3-6-12-21-15/h1-12,16-18,22-24H
InChIKeyNUSDIQFUHBVDSL-UHFFFAOYSA-N
XLogP2.05
TPSA74.76 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.38
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-(diaziridin-3-yl)pyridine
CID 163685048
2,4-dipyridin-2-yl-1,2,3,4-tetrahydropyrimidine
CID 141324793
2-(4-pyridin-2-ylcyclohexa-2,5-dien-1-yl)pyridine
CID 165176425
2-[(2S,3S)-3-(4-chlorophenyl)aziridin-2-yl]pyridine
CID 45115080
2-pyridin-2-yl-2,3-dihydro-1H-perimidine
CID 23989584
2-(4-methylazetidin-2-yl)pyridine
CID 116822058
2-(3,5,7-tripyridin-2-ylcyclooctyl)pyridine
CID 58652114
2-pyridin-2-yl-1,2,3,4a,5,6,7,7a-octahydrocyclopenta[d]pyrimidin-4-one
CID 75596289
2-[(2R)-azetidin-2-yl]pyridine;hydrochloride
CID 171197160
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360

Frequently Asked Questions

What is the IUPAC name of 2,4,6-tripyridin-2-yl-1,3,5-triazinane?
The IUPAC name of 2,4,6-tripyridin-2-yl-1,3,5-triazinane (CID 3057069) is 2,4,6-tripyridin-2-yl-1,3,5-triazinane.
What is the SMILES notation for 2,4,6-tripyridin-2-yl-1,3,5-triazinane?
The canonical SMILES for 2,4,6-tripyridin-2-yl-1,3,5-triazinane is c1ccc(C2NC(c3ccccn3)NC(c3ccccn3)N2)nc1.
What is the InChIKey of 2,4,6-tripyridin-2-yl-1,3,5-triazinane?
The InChIKey is NUSDIQFUHBVDSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N6/c1-4-10-19-13(7-1)16-22-17(14-8-2-5-11-20-14)24-18(23-16)15-9-3-6-12-21-15/h1-12,16-18,22-24H.
What are the key properties of 2,4,6-tripyridin-2-yl-1,3,5-triazinane?
2,4,6-tripyridin-2-yl-1,3,5-triazinane has a molecular weight of 318.38 g/mol, XLogP of 2.05, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-tripyridin-2-yl-1,3,5-triazinane is sourced from PubChem (CID 3057069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).