2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine

C11H9N3OS — CID 104806532

IUPAC2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1ccoc1-c1nc(N)c2ccsc2n1
InChIInChI=1S/C11H9N3OS/c1-6-2-4-15-8(6)10-13-9(12)7-3-5-16-11(7)14-10/h2-5H,1H3,(H2,12,13,14)
InChIKeyWVQIKGYOAQLIPD-UHFFFAOYSA-N
MW231.28 g/mol
LogP2.84
Rot. Bonds1

About 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine

2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 104806532) has the molecular formula C11H9N3OS and a molecular weight of 231.28 g/mol. Its IUPAC name is 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID104806532
Molecular FormulaC11H9N3OS
Molecular Weight231.28 g/mol
Exact Mass231.05
IUPAC Name2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
SMILESCc1ccoc1-c1nc(N)c2ccsc2n1
InChIInChI=1S/C11H9N3OS/c1-6-2-4-15-8(6)10-13-9(12)7-3-5-16-11(7)14-10/h2-5H,1H3,(H2,12,13,14)
InChIKeyWVQIKGYOAQLIPD-UHFFFAOYSA-N
XLogP2.84
TPSA64.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 104806564
6-ethyl-5-methyl-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806721
2-(5-propan-2-ylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine
CID 59276706
5-bromo-2-(3-methylfuran-2-yl)-6-(2-methylpropyl)pyrimidin-4-amine
CID 104806896
5-bromo-2-(3-methylfuran-2-yl)-6-propan-2-ylpyrimidin-4-amine
CID 113455467
5-bromo-6-(methoxymethyl)-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806840
6-cyclopropyl-5-iodo-2-(3-methylfuran-2-yl)pyrimidin-4-amine
CID 104806878
2-[(3,4-dimethylphenyl)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 55130279
2-[(2,4,6-trimethylphenoxy)methyl]thieno[2,3-d]pyrimidin-4-amine
CID 62188361
4-(5-methylpyrimidin-2-yl)sulfanylthieno[2,3-d]pyrimidin-2-amine
CID 103334697
[10-(3-methylfuran-2-yl)-7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl]hydrazine
CID 104806953
4-methyl-5-[3-(3-methylfuran-2-yl)-1,2,4-oxadiazol-5-yl]-1,3-thiazol-2-amine
CID 113454316

Frequently Asked Questions

What is the IUPAC name of 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine (CID 104806532) is 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine is Cc1ccoc1-c1nc(N)c2ccsc2n1.
What is the InChIKey of 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is WVQIKGYOAQLIPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3OS/c1-6-2-4-15-8(6)10-13-9(12)7-3-5-16-11(7)14-10/h2-5H,1H3,(H2,12,13,14).
What are the key properties of 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine?
2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 231.28 g/mol, XLogP of 2.84, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methylfuran-2-yl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 104806532), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).