[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

C6H5N5O — CID 577503

IUPAC[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESNC(=O)c1nc2ncccn2n1
InChIInChI=1S/C6H5N5O/c7-4(12)5-9-6-8-2-1-3-11(6)10-5/h1-3H,(H2,7,12)
InChIKeyGJLRTRVLMPTJPR-UHFFFAOYSA-N
MW163.14 g/mol
LogP-0.78
Rot. Bonds1

About [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide

[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (PubChem CID 577503) has the molecular formula C6H5N5O and a molecular weight of 163.14 g/mol. Its IUPAC name is [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.

Molecular Properties

Compound Name[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
PubChem CID577503
Molecular FormulaC6H5N5O
Molecular Weight163.14 g/mol
Exact Mass163.05
IUPAC Name[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
SMILESNC(=O)c1nc2ncccn2n1
InChIInChI=1S/C6H5N5O/c7-4(12)5-9-6-8-2-1-3-11(6)10-5/h1-3H,(H2,7,12)
InChIKeyGJLRTRVLMPTJPR-UHFFFAOYSA-N
XLogP-0.78
TPSA86.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.14
LogP ≤ 5-0.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1,2,4-Triazolo(1,5-a)pyrimidine
CID 636456
1,2,4-Triazolo(1,5-c)pyrimidine
CID 12318765
(1,2,4)Triazolo(1,5-a)pyrimidine-2-carboxylic acid
CID 1263650
[1,2,4]Triazolo[1,5-a]pyrimidin-2-amine
CID 3161243
N-cycloheptyl[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide
CID 644513
[1,2,4]Triazolo[1,5-a]pyrimidin-7-amine
CID 2763474
Pyrazolo(1,5-a)(1,3,5)triazine
CID 21948548
Pyrazolo[1,5-a]pyrimidin-2-amine
CID 45602167
Pyrazolo[1,5-a]pyrimidin-5-amine
CID 55285819
2-((1,2,4)Triazolo(1,5-a)pyrimidin-2-yl)acetic acid
CID 39870222
N-pyrazolo[1,5-a]pyrimidin-3-ylacetamide
CID 172825317
Pyrazolo(1,5-a)(1,3,5)triazin-4-amine
CID 12210227

Frequently Asked Questions

What is the IUPAC name of [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The IUPAC name of [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide (CID 577503) is [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide.
What is the SMILES notation for [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The canonical SMILES for [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is NC(=O)c1nc2ncccn2n1.
What is the InChIKey of [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
The InChIKey is GJLRTRVLMPTJPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5N5O/c7-4(12)5-9-6-8-2-1-3-11(6)10-5/h1-3H,(H2,7,12).
What are the key properties of [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide?
[1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide has a molecular weight of 163.14 g/mol, XLogP of -0.78, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1,2,4]triazolo[1,5-a]pyrimidine-2-carboxamide is sourced from PubChem (CID 577503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).