N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine

C14H16N6 — CID 126805477

IUPACN,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(N(C)Cc2nnc3ccccn23)nc(C)n1
InChIInChI=1S/C14H16N6/c1-10-8-13(16-11(2)15-10)19(3)9-14-18-17-12-6-4-5-7-20(12)14/h4-8H,9H2,1-3H3
InChIKeyYXHXZNHPORLIIF-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.77
Rot. Bonds3

About N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine

N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine (PubChem CID 126805477) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine.

Molecular Properties

Compound NameN,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine
PubChem CID126805477
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC NameN,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine
SMILESCc1cc(N(C)Cc2nnc3ccccn23)nc(C)n1
InChIInChI=1S/C14H16N6/c1-10-8-13(16-11(2)15-10)19(3)9-14-18-17-12-6-4-5-7-20(12)14/h4-8H,9H2,1-3H3
InChIKeyYXHXZNHPORLIIF-UHFFFAOYSA-N
XLogP1.77
TPSA59.21 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4,6-dimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-2-amine
CID 135106778
N-methyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)-5-(trifluoromethyl)pyridin-2-amine
CID 56789627
N-methyl-1-phenyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)tetrazol-5-amine
CID 56789625
3-(4-chlorophenyl)-N-methyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)prop-2-yn-1-amine
CID 84586318
6-chloro-2-methyl-N-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)propyl]pyrimidin-4-amine
CID 71982303
1-(6,7-dihydro-5H-cyclopenta[c]pyridazin-3-yl)-N-methyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)azetidin-3-amine
CID 126919204
2-([1,2,4]triazolo[4,3-a]pyridin-3-yl)ethanol
CID 21265826
3-(phenoxymethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117256973
3-prop-2-enyl-[1,2,4]triazolo[4,3-a]pyridine
CID 68903381
3-[(2-methylphenoxy)methyl]-[1,2,4]triazolo[4,3-a]pyridine
CID 117256976
ethane;3-methyl-[1,2,4]triazolo[4,3-a]pyridine
CID 91210925
1-[[6-(dimethylamino)-2-pyridinyl]methyl]-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)urea
CID 75388974

Frequently Asked Questions

What is the IUPAC name of N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine?
The IUPAC name of N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine (CID 126805477) is N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine.
What is the SMILES notation for N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine?
The canonical SMILES for N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine is Cc1cc(N(C)Cc2nnc3ccccn23)nc(C)n1.
What is the InChIKey of N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine?
The InChIKey is YXHXZNHPORLIIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-10-8-13(16-11(2)15-10)19(3)9-14-18-17-12-6-4-5-7-20(12)14/h4-8H,9H2,1-3H3.
What are the key properties of N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine?
N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine has a molecular weight of 268.32 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,6-trimethyl-N-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)pyrimidin-4-amine is sourced from PubChem (CID 126805477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).