N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine

C19H26N8 — CID 133432465

IUPACN,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine
SMILESCC(C)c1nc(N(C)C)nc(N2CCCC(c3nnc4ccccn34)C2)n1
InChIInChI=1S/C19H26N8/c1-13(2)16-20-18(25(3)4)22-19(21-16)26-10-7-8-14(12-26)17-24-23-15-9-5-6-11-27(15)17/h5-6,9,11,13-14H,7-8,10,12H2,1-4H3
InChIKeyKEKRSWFMTFVUEJ-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.49
Rot. Bonds4

About N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine

N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine (PubChem CID 133432465) has the molecular formula C19H26N8 and a molecular weight of 366.47 g/mol. Its IUPAC name is N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine
PubChem CID133432465
Molecular FormulaC19H26N8
Molecular Weight366.47 g/mol
Exact Mass366.23
IUPAC NameN,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine
SMILESCC(C)c1nc(N(C)C)nc(N2CCCC(c3nnc4ccccn34)C2)n1
InChIInChI=1S/C19H26N8/c1-13(2)16-20-18(25(3)4)22-19(21-16)26-10-7-8-14(12-26)17-24-23-15-9-5-6-11-27(15)17/h5-6,9,11,13-14H,7-8,10,12H2,1-4H3
InChIKeyKEKRSWFMTFVUEJ-UHFFFAOYSA-N
XLogP2.49
TPSA75.34 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine with MolForge

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Related Compounds

3-[1-(4-methoxypyrimidin-2-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 18126831
3-[1-(6-methyl-2-pyridinyl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 86797164
N,N-dimethyl-4-propan-2-yl-6-[3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]piperidin-1-yl]-1,3,5-triazin-2-amine
CID 133421563
3-phenyl-5-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,2,4-oxadiazole
CID 42955986
3-[1-(1H-pyrrolo[2,3-b]pyridin-6-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 56899043
5-phenyl-2-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3-thiazole
CID 133358948
6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]tetrazolo[1,5-b]pyridazine
CID 24590309
3-[1-(1-phenyltetrazol-5-yl)piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 17418452
4-(1,3,3a,4,5,6,7,7a-octahydroisoindol-2-yl)-N,N-dimethyl-6-propan-2-yl-1,3,5-triazin-2-amine
CID 133418859
1-phenyl-2-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethanol
CID 111436337
2-hydroxy-2-phenyl-1-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]ethanone
CID 110881752
3-[(3S)-1-[(1-methylsulfanylcyclopropyl)methyl]piperidin-3-yl]-[1,2,4]triazolo[4,3-a]pyridine
CID 100624676

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine?
The IUPAC name of N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine (CID 133432465) is N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine.
What is the SMILES notation for N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine?
The canonical SMILES for N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine is CC(C)c1nc(N(C)C)nc(N2CCCC(c3nnc4ccccn34)C2)n1.
What is the InChIKey of N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine?
The InChIKey is KEKRSWFMTFVUEJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N8/c1-13(2)16-20-18(25(3)4)22-19(21-16)26-10-7-8-14(12-26)17-24-23-15-9-5-6-11-27(15)17/h5-6,9,11,13-14H,7-8,10,12H2,1-4H3.
What are the key properties of N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine?
N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine has a molecular weight of 366.47 g/mol, XLogP of 2.49, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-propan-2-yl-6-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]-1,3,5-triazin-2-amine is sourced from PubChem (CID 133432465), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).