acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine

C16H14N6O3 — CID 110170704

IUPACacetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCC(=O)O.Nc1nc(-c2ccccn2)nc2cc(-c3ccco3)nn12
InChIInChI=1S/C14H10N6O.C2H4O2/c15-14-18-13(9-4-1-2-6-16-9)17-12-8-10(19-20(12)14)11-5-3-7-21-11;1-2(3)4/h1-8H,(H2,15,17,18);1H3,(H,3,4)
InChIKeyTVUVYKVCUAQTOA-UHFFFAOYSA-N
MW338.33 g/mol
LogP2.12
Rot. Bonds2

About acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine

acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine (PubChem CID 110170704) has the molecular formula C16H14N6O3 and a molecular weight of 338.33 g/mol. Its IUPAC name is acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine.

Molecular Properties

Compound Nameacetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
PubChem CID110170704
Molecular FormulaC16H14N6O3
Molecular Weight338.33 g/mol
Exact Mass338.11
IUPAC Nameacetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
SMILESCC(=O)O.Nc1nc(-c2ccccn2)nc2cc(-c3ccco3)nn12
InChIInChI=1S/C14H10N6O.C2H4O2/c15-14-18-13(9-4-1-2-6-16-9)17-12-8-10(19-20(12)14)11-5-3-7-21-11;1-2(3)4/h1-8H,(H2,15,17,18);1H3,(H,3,4)
InChIKeyTVUVYKVCUAQTOA-UHFFFAOYSA-N
XLogP2.12
TPSA132.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.33
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

7-(furan-2-yl)-2-(methoxymethyl)pyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 110170670
2-(2-ethoxyethyl)-7-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 110170669
2-[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]benzaldehyde
CID 86603876
2-[2-(furan-2-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidin-6-yl]acetic acid
CID 82269761
1-[4-[3-[5-amino-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidin-7-yl]phenyl]piperazin-1-yl]ethanone
CID 23570263
7-(furan-2-yl)-2-piperazin-1-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine
CID 69432521
4-[4-[2-[[4-amino-7-(furan-2-yl)pyrazolo[1,5-a][1,3,5]triazin-2-yl]-methylamino]ethyl]piperazin-1-yl]-3-fluorobenzoic acid
CID 146467968
7-(furan-2-yl)-2,4-dimethylpyrazolo[1,5-a][1,3,5]triazine
CID 13424971
1-[5-amino-3-(furan-2-yl)-1,2,4-triazol-1-yl]ethanone
CID 757187
5-amino-N,N-diethyl-2-pyridin-2-yl-[1,2,4]triazolo[1,5-a]pyridine-7-carboxamide
CID 23552688
5-amino-N-[1-(2-chloro-3-pyridinyl)propyl]-2-(furan-2-yl)-[1,2,4]triazolo[1,5-c]pyrimidine-7-carboxamide
CID 140500884
2-(furan-2-yl)-7-methyl-N-(1-phenylethyl)pyrazolo[1,5-a]pyrimidine-5-carboxamide
CID 53040536

Frequently Asked Questions

What is the IUPAC name of acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The IUPAC name of acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine (CID 110170704) is acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine.
What is the SMILES notation for acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The canonical SMILES for acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine is CC(=O)O.Nc1nc(-c2ccccn2)nc2cc(-c3ccco3)nn12.
What is the InChIKey of acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
The InChIKey is TVUVYKVCUAQTOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N6O.C2H4O2/c15-14-18-13(9-4-1-2-6-16-9)17-12-8-10(19-20(12)14)11-5-3-7-21-11;1-2(3)4/h1-8H,(H2,15,17,18);1H3,(H,3,4).
What are the key properties of acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine?
acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine has a molecular weight of 338.33 g/mol, XLogP of 2.12, 2 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for acetic acid;7-(furan-2-yl)-2-pyridin-2-ylpyrazolo[1,5-a][1,3,5]triazin-4-amine is sourced from PubChem (CID 110170704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).