2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine

C19H32N6 — CID 790419

IUPAC2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
SMILESCC1CCN(c2nc(N3CCCCC3)nc(N3CCCCC3)n2)CC1
InChIInChI=1S/C19H32N6/c1-16-8-14-25(15-9-16)19-21-17(23-10-4-2-5-11-23)20-18(22-19)24-12-6-3-7-13-24/h16H,2-15H2,1H3
InChIKeyLFGIIJAAPULQBU-UHFFFAOYSA-N
MW344.51 g/mol
LogP3.09
Rot. Bonds3

About 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine

2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine (PubChem CID 790419) has the molecular formula C19H32N6 and a molecular weight of 344.51 g/mol. Its IUPAC name is 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine.

Molecular Properties

Compound Name2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
PubChem CID790419
Molecular FormulaC19H32N6
Molecular Weight344.51 g/mol
Exact Mass344.27
IUPAC Name2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine
SMILESCC1CCN(c2nc(N3CCCCC3)nc(N3CCCCC3)n2)CC1
InChIInChI=1S/C19H32N6/c1-16-8-14-25(15-9-16)19-21-17(23-10-4-2-5-11-23)20-18(22-19)24-12-6-3-7-13-24/h16H,2-15H2,1H3
InChIKeyLFGIIJAAPULQBU-UHFFFAOYSA-N
XLogP3.09
TPSA48.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.51
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2,4,6-Tri(piperidin-1-yl)-1,3,5-triazine
CID 2827031
2,4,6-Tris(4-methylpiperidin-1-yl)-1,3,5-triazine
CID 1035143
2-Chloro-4,6-bis(4-methylpiperidin-1-yl)-1,3,5-triazine
CID 698431
N,N-dimethyl-4,6-di(piperidin-1-yl)-1,3,5-triazin-2-amine
CID 719062
2-Chloro-4,6-bis(3,5-dimethylpiperidin-1-yl)-1,3,5-triazine
CID 129874860
N,N-diethyl-4,6-bis(1-methylpiperidin-1-ium-1-yl)-1,3,5-triazin-2-amine
CID 162403833
4,6-bis(1-methylpiperidin-1-ium-1-yl)-N,N-di(propan-2-yl)-1,3,5-triazin-2-amine
CID 162403944
2,4,6-Tris(2-methylpiperidin-1-yl)-1,3,5-triazine
CID 4353525
2-Chloro-4,6-bis(4-methylpiperidin-1-yl)-1,3,5-triazine;hydrochloride
CID 126477522
1-(4,6-Diethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane
CID 9839863
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane chloride
CID 9882357
1-(4,6-Dimethoxy-1,3,5-triazin-2-yl)-1-azoniabicyclo[2.2.2]octane
CID 9882358

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine?
The IUPAC name of 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine (CID 790419) is 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine.
What is the SMILES notation for 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine?
The canonical SMILES for 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine is CC1CCN(c2nc(N3CCCCC3)nc(N3CCCCC3)n2)CC1.
What is the InChIKey of 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine?
The InChIKey is LFGIIJAAPULQBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H32N6/c1-16-8-14-25(15-9-16)19-21-17(23-10-4-2-5-11-23)20-18(22-19)24-12-6-3-7-13-24/h16H,2-15H2,1H3.
What are the key properties of 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine?
2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine has a molecular weight of 344.51 g/mol, XLogP of 3.09, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylpiperidin-1-yl)-4,6-di(piperidin-1-yl)-1,3,5-triazine is sourced from PubChem (CID 790419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).