4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine

C11H16N4S — CID 103324155

IUPAC4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCNc1nc(NC)nc2sc(CC)cc12
InChIInChI=1S/C11H16N4S/c1-4-7-6-8-9(13-5-2)14-11(12-3)15-10(8)16-7/h6H,4-5H2,1-3H3,(H2,12,13,14,15)
InChIKeyZDSBSAXBPKMREQ-UHFFFAOYSA-N
MW236.34 g/mol
LogP2.73
Rot. Bonds4

About 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine

4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103324155) has the molecular formula C11H16N4S and a molecular weight of 236.34 g/mol. Its IUPAC name is 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103324155
Molecular FormulaC11H16N4S
Molecular Weight236.34 g/mol
Exact Mass236.11
IUPAC Name4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCNc1nc(NC)nc2sc(CC)cc12
InChIInChI=1S/C11H16N4S/c1-4-7-6-8-9(13-5-2)14-11(12-3)15-10(8)16-7/h6H,4-5H2,1-3H3,(H2,12,13,14,15)
InChIKeyZDSBSAXBPKMREQ-UHFFFAOYSA-N
XLogP2.73
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 52.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-ethyl-2-N-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324044
N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
6-ethyl-4-N-(2-methoxypropyl)-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103330779
6-ethyl-2-N-methyl-4-N-[(2-methyl-1,3-thiazol-5-yl)methyl]thieno[2,3-d]pyrimidine-2,4-diamine
CID 103326140
6-ethyl-2-N-methyl-4-N-(2-methyl-3-methylsulfanylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328043
4-N-(2,2-dimethylbutyl)-2-N,6-diethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103466672
6-ethyl-2-N-methyl-4-N-(oxan-4-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327900
3-[[[6-ethyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]pentan-1-ol
CID 103329093
6-ethyl-2-N-methyl-4-N-(1,3-thiazol-4-ylmethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327929
6-ethyl-4-N-[2-(2-methoxyethoxy)ethyl]-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103326772
ethyl 2-[[6-ethyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]acetate
CID 103325279
3-[2-[[6-ethyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]ethylsulfanyl]propan-1-ol
CID 106311692

Frequently Asked Questions

What is the IUPAC name of 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103324155) is 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine is CCNc1nc(NC)nc2sc(CC)cc12.
What is the InChIKey of 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is ZDSBSAXBPKMREQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4S/c1-4-7-6-8-9(13-5-2)14-11(12-3)15-10(8)16-7/h6H,4-5H2,1-3H3,(H2,12,13,14,15).
What are the key properties of 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine?
4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 236.34 g/mol, XLogP of 2.73, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103324155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).