7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

C10H13N5O2 — CID 43428052

IUPAC7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCCc1c(C(=O)NCCO)cnc2ncnn12
InChIInChI=1S/C10H13N5O2/c1-2-8-7(9(17)11-3-4-16)5-12-10-13-6-14-15(8)10/h5-6,16H,2-4H2,1H3,(H,11,17)
InChIKeyCUVJXYFNYPZXMT-UHFFFAOYSA-N
MW235.25 g/mol
LogP-0.59
Rot. Bonds4

About 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide

7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (PubChem CID 43428052) has the molecular formula C10H13N5O2 and a molecular weight of 235.25 g/mol. Its IUPAC name is 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.

Molecular Properties

Compound Name7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
PubChem CID43428052
Molecular FormulaC10H13N5O2
Molecular Weight235.25 g/mol
Exact Mass235.11
IUPAC Name7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide
SMILESCCc1c(C(=O)NCCO)cnc2ncnn12
InChIInChI=1S/C10H13N5O2/c1-2-8-7(9(17)11-3-4-16)5-12-10-13-6-14-15(8)10/h5-6,16H,2-4H2,1H3,(H,11,17)
InChIKeyCUVJXYFNYPZXMT-UHFFFAOYSA-N
XLogP-0.59
TPSA92.41 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 5-0.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The IUPAC name of 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide (CID 43428052) is 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide.
What is the SMILES notation for 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The canonical SMILES for 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is CCc1c(C(=O)NCCO)cnc2ncnn12.
What is the InChIKey of 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
The InChIKey is CUVJXYFNYPZXMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O2/c1-2-8-7(9(17)11-3-4-16)5-12-10-13-6-14-15(8)10/h5-6,16H,2-4H2,1H3,(H,11,17).
What are the key properties of 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide?
7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide has a molecular weight of 235.25 g/mol, XLogP of -0.59, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-N-(2-hydroxyethyl)-[1,2,4]triazolo[1,5-a]pyrimidine-6-carboxamide is sourced from PubChem (CID 43428052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).