7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine

C9H6N4O — CID 1476956

IUPAC7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1coc(-c2ccnc3ncnn23)c1
InChIInChI=1S/C9H6N4O/c1-2-8(14-5-1)7-3-4-10-9-11-6-12-13(7)9/h1-6H
InChIKeyULVULLUWKSHJFU-UHFFFAOYSA-N
MW186.17 g/mol
LogP1.38
Rot. Bonds1

About 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine

7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine (PubChem CID 1476956) has the molecular formula C9H6N4O and a molecular weight of 186.17 g/mol. Its IUPAC name is 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine.

Molecular Properties

Compound Name7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
PubChem CID1476956
Molecular FormulaC9H6N4O
Molecular Weight186.17 g/mol
Exact Mass186.05
IUPAC Name7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine
SMILESc1coc(-c2ccnc3ncnn23)c1
InChIInChI=1S/C9H6N4O/c1-2-8(14-5-1)7-3-4-10-9-11-6-12-13(7)9/h1-6H
InChIKeyULVULLUWKSHJFU-UHFFFAOYSA-N
XLogP1.38
TPSA56.22 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-(Furan-2-yl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
CID 6485369
2-(2-furyl)-6-(1H-pyrazol-1-yl)pyrimidin-4-amine
CID 11424684
6-Amino-N-benzyl-4-(2-furyl)-1H-pyrazolo[3,4-d]pyrimidine-1-carboxamide
CID 22015504
5-(Furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine-2-carboxamide
CID 2056940
4-(2-furyl)-2-(1H-pyrrol-1-yl)pyrimidine
CID 1481666
1-[4-(2-furyl)-2-pyrimidinyl]-1H-pyrrole-2-carbaldehyde
CID 1481670
4-(2-Furyl)-2-(4-pyridinyl)pyrimidine
CID 1485448
5-(2-Furyl)-7-(trifluoromethyl)[1,2,4]triazolo[1,5-a]pyrimidine
CID 760804
1-Azepanyl[5-(2-furyl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-2-yl]methanone
CID 1102035
3-(4-Bromophenyl)-7-(furan-2-yl)-2-methylpyrazolo[1,5-a]pyrimidine
CID 8073338
Azepan-1-yl[5-(furan-2-yl)-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidin-3-yl]methanone
CID 1111056
7-(2-Furyl)[1,2,4]triazolo[1,5-a]pyrimidin-2-ylamine
CID 2764124

Frequently Asked Questions

What is the IUPAC name of 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The IUPAC name of 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine (CID 1476956) is 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine.
What is the SMILES notation for 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The canonical SMILES for 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine is c1coc(-c2ccnc3ncnn23)c1.
What is the InChIKey of 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
The InChIKey is ULVULLUWKSHJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N4O/c1-2-8(14-5-1)7-3-4-10-9-11-6-12-13(7)9/h1-6H.
What are the key properties of 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine?
7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine has a molecular weight of 186.17 g/mol, XLogP of 1.38, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(furan-2-yl)-[1,2,4]triazolo[1,5-a]pyrimidine is sourced from PubChem (CID 1476956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).