N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

C10H13N5 — CID 53259071

IUPACN-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC2CCC2)n2ncnc2n1
InChIInChI=1S/C10H13N5/c1-7-5-9(14-8-3-2-4-8)15-10(13-7)11-6-12-15/h5-6,8,14H,2-4H2,1H3
InChIKeyJUQHAOWSJVXQDD-UHFFFAOYSA-N
MW203.25 g/mol
LogP1.40
Rot. Bonds2

About N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine

N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (PubChem CID 53259071) has the molecular formula C10H13N5 and a molecular weight of 203.25 g/mol. Its IUPAC name is N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.

Molecular Properties

Compound NameN-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
PubChem CID53259071
Molecular FormulaC10H13N5
Molecular Weight203.25 g/mol
Exact Mass203.12
IUPAC NameN-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine
SMILESCc1cc(NC2CCC2)n2ncnc2n1
InChIInChI=1S/C10H13N5/c1-7-5-9(14-8-3-2-4-8)15-10(13-7)11-6-12-15/h5-6,8,14H,2-4H2,1H3
InChIKeyJUQHAOWSJVXQDD-UHFFFAOYSA-N
XLogP1.40
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.25
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The IUPAC name of N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine (CID 53259071) is N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine.
What is the SMILES notation for N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The canonical SMILES for N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is Cc1cc(NC2CCC2)n2ncnc2n1.
What is the InChIKey of N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
The InChIKey is JUQHAOWSJVXQDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5/c1-7-5-9(14-8-3-2-4-8)15-10(13-7)11-6-12-15/h5-6,8,14H,2-4H2,1H3.
What are the key properties of N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine?
N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine has a molecular weight of 203.25 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-5-methyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-amine is sourced from PubChem (CID 53259071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).