4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine

C10H13N3S2 — CID 103334167

IUPAC4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCC(C)(C)Sc1nc(N)nc2sccc12
InChIInChI=1S/C10H13N3S2/c1-10(2,3)15-8-6-4-5-14-7(6)12-9(11)13-8/h4-5H,1-3H3,(H2,11,12,13)
InChIKeyCZZFPPHCOBLCQB-UHFFFAOYSA-N
MW239.37 g/mol
LogP3.16
Rot. Bonds1

About 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine

4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103334167) has the molecular formula C10H13N3S2 and a molecular weight of 239.37 g/mol. Its IUPAC name is 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103334167
Molecular FormulaC10H13N3S2
Molecular Weight239.37 g/mol
Exact Mass239.06
IUPAC Name4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine
SMILESCC(C)(C)Sc1nc(N)nc2sccc12
InChIInChI=1S/C10H13N3S2/c1-10(2,3)15-8-6-4-5-14-7(6)12-9(11)13-8/h4-5H,1-3H3,(H2,11,12,13)
InChIKeyCZZFPPHCOBLCQB-UHFFFAOYSA-N
XLogP3.16
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.37
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-[(3,5-dimethylphenyl)methylsulfanyl]thieno[2,3-d]pyrimidin-2-amine
CID 103335268
4-(5-methylpyrimidin-2-yl)sulfanylthieno[2,3-d]pyrimidin-2-amine
CID 103334697
4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324043
4-(4,4-dimethylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103327459
4-(4-methylpiperidin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103323791
4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324290
2-[[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]methyl]-2-ethylbutan-1-ol
CID 106258455
N-[1-[(2-aminothieno[2,3-d]pyrimidin-4-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 103327980
4-(4-butan-2-ylpiperazin-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103327357
4-(2-methylpropoxy)thieno[2,3-d]pyrimidin-2-amine
CID 103331483
(4-methylsulfanylthieno[2,3-d]pyrimidin-2-yl)hydrazine
CID 103336570
4-N-benzylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324222

Frequently Asked Questions

What is the IUPAC name of 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine (CID 103334167) is 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine is CC(C)(C)Sc1nc(N)nc2sccc12.
What is the InChIKey of 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is CZZFPPHCOBLCQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3S2/c1-10(2,3)15-8-6-4-5-14-7(6)12-9(11)13-8/h4-5H,1-3H3,(H2,11,12,13).
What are the key properties of 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine?
4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 239.37 g/mol, XLogP of 3.16, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-tert-butylsulfanylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103334167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).