5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide

C11H10N6O2 — CID 22002375

IUPAC5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
SMILESCNC(=O)c1cnc(N)n2nc(-c3ccco3)nc12
InChIInChI=1S/C11H10N6O2/c1-13-10(18)6-5-14-11(12)17-9(6)15-8(16-17)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14)(H,13,18)
InChIKeyXXBJWZWBDPCJLY-UHFFFAOYSA-N
MW258.24 g/mol
LogP0.33
Rot. Bonds2

About 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide

5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide (PubChem CID 22002375) has the molecular formula C11H10N6O2 and a molecular weight of 258.24 g/mol. Its IUPAC name is 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide.

Molecular Properties

Compound Name5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
PubChem CID22002375
Molecular FormulaC11H10N6O2
Molecular Weight258.24 g/mol
Exact Mass258.09
IUPAC Name5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide
SMILESCNC(=O)c1cnc(N)n2nc(-c3ccco3)nc12
InChIInChI=1S/C11H10N6O2/c1-13-10(18)6-5-14-11(12)17-9(6)15-8(16-17)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14)(H,13,18)
InChIKeyXXBJWZWBDPCJLY-UHFFFAOYSA-N
XLogP0.33
TPSA111.34 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.24
LogP ≤ 50.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide?
The IUPAC name of 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide (CID 22002375) is 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide.
What is the SMILES notation for 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide?
The canonical SMILES for 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide is CNC(=O)c1cnc(N)n2nc(-c3ccco3)nc12.
What is the InChIKey of 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide?
The InChIKey is XXBJWZWBDPCJLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6O2/c1-13-10(18)6-5-14-11(12)17-9(6)15-8(16-17)7-3-2-4-19-7/h2-5H,1H3,(H2,12,14)(H,13,18).
What are the key properties of 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide?
5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide has a molecular weight of 258.24 g/mol, XLogP of 0.33, 2 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-(furan-2-yl)-N-methyl-[1,2,4]triazolo[1,5-c]pyrimidine-8-carboxamide is sourced from PubChem (CID 22002375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).