N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

C14H20N6 — CID 133281627

IUPACN-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1cc(NC2CCc3ncnn3C2)nc(C(C)C)n1
InChIInChI=1S/C14H20N6/c1-9(2)14-17-10(3)6-12(19-14)18-11-4-5-13-15-8-16-20(13)7-11/h6,8-9,11H,4-5,7H2,1-3H3,(H,17,18,19)
InChIKeyAQPKEZXOMOJEFO-UHFFFAOYSA-N
MW272.36 g/mol
LogP1.93
Rot. Bonds3

About N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine

N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (PubChem CID 133281627) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.

Molecular Properties

Compound NameN-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
PubChem CID133281627
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC NameN-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
SMILESCc1cc(NC2CCc3ncnn3C2)nc(C(C)C)n1
InChIInChI=1S/C14H20N6/c1-9(2)14-17-10(3)6-12(19-14)18-11-4-5-13-15-8-16-20(13)7-11/h6,8-9,11H,4-5,7H2,1-3H3,(H,17,18,19)
InChIKeyAQPKEZXOMOJEFO-UHFFFAOYSA-N
XLogP1.93
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-2-propan-2-yl-N-(1,2,3,4-tetrahydronaphthalen-2-yl)pyrimidin-4-amine
CID 60651523
N-(6-chloropyrazin-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133281563
4-[(6-methyl-2-propan-2-ylpyrimidin-4-yl)amino]cyclohexan-1-ol
CID 43395250
N-(2-methylpropyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 130678390
6-methyl-N-(3-methylcyclobutyl)-2-propan-2-ylpyrimidin-4-amine
CID 115697112
N-[6-(trifluoromethyl)-2-pyridinyl]-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133281569
N-(1-ethylpiperidin-4-yl)-6-methyl-2-propan-2-ylpyrimidin-4-amine
CID 60667015
N-(3-methoxybutan-2-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 115889496
N-(2-benzylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133443339
N-(3-methyl-5-nitro-2-pyridinyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133281537
6-methyl-N-(2-methyloxan-4-yl)-2-propan-2-ylpyrimidin-4-amine
CID 103889167
5-[(6-chloro-2-propan-2-ylpyrimidin-4-yl)amino]-1-methylpiperidin-2-one
CID 80950848

Frequently Asked Questions

What is the IUPAC name of N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The IUPAC name of N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine (CID 133281627) is N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine.
What is the SMILES notation for N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The canonical SMILES for N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is Cc1cc(NC2CCc3ncnn3C2)nc(C(C)C)n1.
What is the InChIKey of N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
The InChIKey is AQPKEZXOMOJEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-9(2)14-17-10(3)6-12(19-14)18-11-4-5-13-15-8-16-20(13)7-11/h6,8-9,11H,4-5,7H2,1-3H3,(H,17,18,19).
What are the key properties of N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine?
N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine has a molecular weight of 272.36 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-2-propan-2-ylpyrimidin-4-yl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine is sourced from PubChem (CID 133281627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).