5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one

C10H6N2O2S — CID 142578268

IUPAC5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one
SMILESO=c1[nH]cnc2occ(-c3cccs3)c12
InChIInChI=1S/C10H6N2O2S/c13-9-8-6(7-2-1-3-15-7)4-14-10(8)12-5-11-9/h1-5H,(H,11,12,13)
InChIKeyHAHUKFGTQZRUTN-UHFFFAOYSA-N
MW218.24 g/mol
LogP2.24
Rot. Bonds1

About 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one

5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one (PubChem CID 142578268) has the molecular formula C10H6N2O2S and a molecular weight of 218.24 g/mol. Its IUPAC name is 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one
PubChem CID142578268
Molecular FormulaC10H6N2O2S
Molecular Weight218.24 g/mol
Exact Mass218.01
IUPAC Name5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one
SMILESO=c1[nH]cnc2occ(-c3cccs3)c12
InChIInChI=1S/C10H6N2O2S/c13-9-8-6(7-2-1-3-15-7)4-14-10(8)12-5-11-9/h1-5H,(H,11,12,13)
InChIKeyHAHUKFGTQZRUTN-UHFFFAOYSA-N
XLogP2.24
TPSA58.89 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.24
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-3H-furo[2,3-d]pyrimidin-4-one
CID 53213978
6-oxo-4-thiophen-2-yl-1H-pyrimidine-5-carbonitrile
CID 175816359
5-thiophen-2-yl-1H-triazin-6-one
CID 141174792
4,7-dithiophen-2-yl-3H-imidazo[4,5-c]pyridine
CID 101144963
5-methyl-7-thiophen-2-yl-3H-pyrrolo[2,3-d]pyrimidin-4-one
CID 141280190
5-iodo-4-(2-thiophen-2-ylethoxy)-1H-pyrimidin-6-one
CID 114676343
3-thiophen-2-ylpyridine-2-carbaldehyde
CID 86594751
2-thiophen-2-ylcyclohepta-2,4,6-trien-1-one
CID 142643105
3-amino-5H-[1,2]oxazolo[5,4-d]pyrimidin-4-one
CID 178200218
2-methyl-3-thiophen-2-ylpyridine
CID 118471782
2,3-diphenyl-8-thiophen-2-yl-6H-1,6-naphthyridin-5-one
CID 173038182
3-iodo-4-thiophen-2-yl-1,2-oxazole
CID 166786121

Frequently Asked Questions

What is the IUPAC name of 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one?
The IUPAC name of 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one (CID 142578268) is 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one?
The canonical SMILES for 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one is O=c1[nH]cnc2occ(-c3cccs3)c12.
What is the InChIKey of 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one?
The InChIKey is HAHUKFGTQZRUTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N2O2S/c13-9-8-6(7-2-1-3-15-7)4-14-10(8)12-5-11-9/h1-5H,(H,11,12,13).
What are the key properties of 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one?
5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one has a molecular weight of 218.24 g/mol, XLogP of 2.24, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-thiophen-2-yl-3H-furo[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 142578268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).