3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one

C10H7N3O2S — CID 711166

IUPAC3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one
SMILESNn1cnc2scc(-c3ccco3)c2c1=O
InChIInChI=1S/C10H7N3O2S/c11-13-5-12-9-8(10(13)14)6(4-16-9)7-2-1-3-15-7/h1-5H,11H2
InChIKeyWYCWMBNIYAEFFF-UHFFFAOYSA-N
MW233.25 g/mol
LogP1.43
Rot. Bonds1

About 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one

3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one (PubChem CID 711166) has the molecular formula C10H7N3O2S and a molecular weight of 233.25 g/mol. Its IUPAC name is 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one
PubChem CID711166
Molecular FormulaC10H7N3O2S
Molecular Weight233.25 g/mol
Exact Mass233.03
IUPAC Name3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one
SMILESNn1cnc2scc(-c3ccco3)c2c1=O
InChIInChI=1S/C10H7N3O2S/c11-13-5-12-9-8(10(13)14)6(4-16-9)7-2-1-3-15-7/h1-5H,11H2
InChIKeyWYCWMBNIYAEFFF-UHFFFAOYSA-N
XLogP1.43
TPSA74.05 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.25
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[(E)-furan-2-ylmethylideneamino]-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one
CID 5339681
2-(Difluoromethylsulfanyl)-5-(furan-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
CID 2119359
3-allyl-5-(5-methyl-2-furyl)-2-[(2-oxopropyl)thio]thieno[2,3-d]pyrimidin-4(3H)-one
CID 1189912
3-amino-2-methyl-5-(5-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4(3H)-one
CID 1536865
N-cyclopentyl-2-[5-(furan-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
CID 2089750
2-Benzylsulfanyl-5-(5-methylfuran-2-yl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
CID 2243314
5-(Furan-2-yl)-2-(2-oxopropylsulfanyl)-3-prop-2-enylthieno[2,3-d]pyrimidin-4-one
CID 2386969
2-{[3-allyl-5-(2-furyl)-4-oxo-3,4-dihydrothieno[2,3-d]pyrimidin-2-yl]thio}-N-(tetrahydro-2-furanylmethyl)acetamide
CID 2939726
N'-[5-(furan-2-yl)-2-methyl-4-oxothieno[2,3-d]pyrimidin-3-yl]-N,N-dimethylmethanimidamide
CID 9554676
2-[5-(5-Methylfuran-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
CID 1281395
3-allyl-5-(2-furyl)-2-{[2-(4-morpholinyl)-2-oxoethyl]thio}thieno[2,3-d]pyrimidin-4(3H)-one
CID 1281397
N-butyl-2-[5-(furan-2-yl)-4-oxo-3-prop-2-enylthieno[2,3-d]pyrimidin-2-yl]sulfanylacetamide
CID 2089751

Frequently Asked Questions

What is the IUPAC name of 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one?
The IUPAC name of 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one (CID 711166) is 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one?
The canonical SMILES for 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one is Nn1cnc2scc(-c3ccco3)c2c1=O.
What is the InChIKey of 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one?
The InChIKey is WYCWMBNIYAEFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O2S/c11-13-5-12-9-8(10(13)14)6(4-16-9)7-2-1-3-15-7/h1-5H,11H2.
What are the key properties of 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one?
3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one has a molecular weight of 233.25 g/mol, XLogP of 1.43, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-5-(furan-2-yl)thieno[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 711166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).