N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide

C10H11N5O2 — CID 6471603

IUPACN-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide
SMILESCc1cc(=O)n2[nH]c(NC(=O)C3CC3)nc2n1
InChIInChI=1S/C10H11N5O2/c1-5-4-7(16)15-10(11-5)13-9(14-15)12-8(17)6-2-3-6/h4,6H,2-3H2,1H3,(H2,11,12,13,14,17)
InChIKeyOOHRMQNSAPLGHG-UHFFFAOYSA-N
MW233.23 g/mol
LogP0.07
Rot. Bonds2

About N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide

N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide (PubChem CID 6471603) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide.

Molecular Properties

Compound NameN-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide
PubChem CID6471603
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC NameN-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide
SMILESCc1cc(=O)n2[nH]c(NC(=O)C3CC3)nc2n1
InChIInChI=1S/C10H11N5O2/c1-5-4-7(16)15-10(11-5)13-9(14-15)12-8(17)6-2-3-6/h4,6H,2-3H2,1H3,(H2,11,12,13,14,17)
InChIKeyOOHRMQNSAPLGHG-UHFFFAOYSA-N
XLogP0.07
TPSA92.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 50.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide?
The IUPAC name of N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide (CID 6471603) is N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide.
What is the SMILES notation for N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide?
The canonical SMILES for N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide is Cc1cc(=O)n2[nH]c(NC(=O)C3CC3)nc2n1.
What is the InChIKey of N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide?
The InChIKey is OOHRMQNSAPLGHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-5-4-7(16)15-10(11-5)13-9(14-15)12-8(17)6-2-3-6/h4,6H,2-3H2,1H3,(H2,11,12,13,14,17).
What are the key properties of N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide?
N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide has a molecular weight of 233.23 g/mol, XLogP of 0.07, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methyl-7-oxo-1H-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)cyclopropanecarboxamide is sourced from PubChem (CID 6471603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).