6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine

C11H9N3S3 — CID 103334108

IUPAC6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(Sc3cccs3)nc(N)nc2s1
InChIInChI=1S/C11H9N3S3/c1-6-5-7-9(16-6)13-11(12)14-10(7)17-8-3-2-4-15-8/h2-5H,1H3,(H2,12,13,14)
InChIKeyMRPXYKSYRZNJDL-UHFFFAOYSA-N
MW279.41 g/mol
LogP3.79
Rot. Bonds2

About 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine

6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103334108) has the molecular formula C11H9N3S3 and a molecular weight of 279.41 g/mol. Its IUPAC name is 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103334108
Molecular FormulaC11H9N3S3
Molecular Weight279.41 g/mol
Exact Mass279.00
IUPAC Name6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCc1cc2c(Sc3cccs3)nc(N)nc2s1
InChIInChI=1S/C11H9N3S3/c1-6-5-7-9(16-6)13-11(12)14-10(7)17-8-3-2-4-15-8/h2-5H,1H3,(H2,12,13,14)
InChIKeyMRPXYKSYRZNJDL-UHFFFAOYSA-N
XLogP3.79
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.41
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-methyl-4-(3-methylphenyl)sulfanylthieno[2,3-d]pyrimidin-2-amine
CID 103334621
6-methyl-4-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]thieno[2,3-d]pyrimidin-2-amine
CID 103335328
4-(1H-imidazol-2-ylsulfanyl)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 107784926
4-(2,3-dihydro-1H-inden-5-ylsulfanyl)-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103334004
4-butan-2-ylsulfanyl-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103334135
6-methyl-4-(3-methylbutylsulfanyl)thieno[2,3-d]pyrimidin-2-amine
CID 107765903
6-methyl-4-N-(2-thiophen-2-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324377
6-methyl-4-N-(1-thiophen-3-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327402
3-methyl-5-thiophen-2-ylsulfanylaniline
CID 112648742
5-methyl-2-propan-2-yl-6-thiophen-2-ylsulfanylpyrimidin-4-amine
CID 80989981
2-chloro-5-methyl-4-thiophen-2-ylsulfanylpyrimidine
CID 79073513
6-chloro-2-thiophen-2-ylsulfanylpyridin-3-amine
CID 115474595

Frequently Asked Questions

What is the IUPAC name of 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine (CID 103334108) is 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine is Cc1cc2c(Sc3cccs3)nc(N)nc2s1.
What is the InChIKey of 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is MRPXYKSYRZNJDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3S3/c1-6-5-7-9(16-6)13-11(12)14-10(7)17-8-3-2-4-15-8/h2-5H,1H3,(H2,12,13,14).
What are the key properties of 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine?
6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 279.41 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-4-thiophen-2-ylsulfanylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103334108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).