4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine

C12H16N4S — CID 103327219

IUPAC4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCc1cc2c(NC3CCC3)nc(N)nc2s1
InChIInChI=1S/C12H16N4S/c1-2-8-6-9-10(14-7-4-3-5-7)15-12(13)16-11(9)17-8/h6-7H,2-5H2,1H3,(H3,13,14,15,16)
InChIKeyGHXUFYWIVVZXTH-UHFFFAOYSA-N
MW248.35 g/mol
LogP2.80
Rot. Bonds3

About 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine

4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103327219) has the molecular formula C12H16N4S and a molecular weight of 248.35 g/mol. Its IUPAC name is 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103327219
Molecular FormulaC12H16N4S
Molecular Weight248.35 g/mol
Exact Mass248.11
IUPAC Name4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCc1cc2c(NC3CCC3)nc(N)nc2s1
InChIInChI=1S/C12H16N4S/c1-2-8-6-9-10(14-7-4-3-5-7)15-12(13)16-11(9)17-8/h6-7H,2-5H2,1H3,(H3,13,14,15,16)
InChIKeyGHXUFYWIVVZXTH-UHFFFAOYSA-N
XLogP2.80
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.35
LogP ≤ 52.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-ethyl-4-N-(4-methylcyclohexyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324441
6-ethyl-4-N-(3-ethylcyclohexyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328382
6-ethyl-4-N-(oxan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327762
6-ethyl-4-N-(1-methylpiperidin-4-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103324772
6-ethyl-4-N-(thiolan-3-yl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103330885
[2-[[(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]cyclopentyl]methanol
CID 103328658
2-chloro-6-ethyl-N-(4-methylcyclohexyl)thieno[2,3-d]pyrimidin-4-amine
CID 103320521
6-ethyl-4-N-hexylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103328125
6-ethyl-4-N-[(1-methylcyclopentyl)methyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327914
6-ethyl-4-N-(2-pyrrolidin-1-ylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103329267
4-N-(2,2-dimethylbutyl)-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103466671
2-[(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)amino]-2-ethylbutan-1-ol
CID 103327283

Frequently Asked Questions

What is the IUPAC name of 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103327219) is 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine is CCc1cc2c(NC3CCC3)nc(N)nc2s1.
What is the InChIKey of 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is GHXUFYWIVVZXTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4S/c1-2-8-6-9-10(14-7-4-3-5-7)15-12(13)16-11(9)17-8/h6-7H,2-5H2,1H3,(H3,13,14,15,16).
What are the key properties of 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine?
4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 248.35 g/mol, XLogP of 2.80, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-cyclobutyl-6-ethylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103327219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).