N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine

C15H19N5S — CID 103331057

IUPACN,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(-n2ccnc2CC)c2cc(CC)sc2n1
InChIInChI=1S/C15H19N5S/c1-4-10-9-11-13(20-8-7-17-12(20)5-2)18-15(16-6-3)19-14(11)21-10/h7-9H,4-6H2,1-3H3,(H,16,18,19)
InChIKeyYPQHXHDNKQRGPU-UHFFFAOYSA-N
MW301.42 g/mol
LogP3.43
Rot. Bonds5

About N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine

N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine (PubChem CID 103331057) has the molecular formula C15H19N5S and a molecular weight of 301.42 g/mol. Its IUPAC name is N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound NameN,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
PubChem CID103331057
Molecular FormulaC15H19N5S
Molecular Weight301.42 g/mol
Exact Mass301.14
IUPAC NameN,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(-n2ccnc2CC)c2cc(CC)sc2n1
InChIInChI=1S/C15H19N5S/c1-4-10-9-11-13(20-8-7-17-12(20)5-2)18-15(16-6-3)19-14(11)21-10/h7-9H,4-6H2,1-3H3,(H,16,18,19)
InChIKeyYPQHXHDNKQRGPU-UHFFFAOYSA-N
XLogP3.43
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.42
LogP ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

6-ethyl-N-methyl-4-(2-propylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103331127
4-(4-chloropyrazol-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
CID 103331015
4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
CID 103327611
N,6-diethyl-4-(3-methylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103328077
4-N-(2,2-dimethylbutyl)-2-N,6-diethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103466672
4-N-[2-(dimethylamino)ethyl]-2-N,6-diethyl-4-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103327863
4-[(E)-but-2-enoxy]-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
CID 103332325
4-N,6-diethyl-2-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324155
4-N-cyclopropyl-2-N,6-diethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324607
N,6-diethyl-4-(3-methylbutan-2-ylsulfanyl)thieno[2,3-d]pyrimidin-2-amine
CID 107765560
N,6-diethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-amine
CID 103335153
4-ethoxy-N-ethyl-6-(2-ethylimidazol-1-yl)-1,3,5-triazin-2-amine
CID 80857032

Frequently Asked Questions

What is the IUPAC name of N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine (CID 103331057) is N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine is CCNc1nc(-n2ccnc2CC)c2cc(CC)sc2n1.
What is the InChIKey of N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine?
The InChIKey is YPQHXHDNKQRGPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5S/c1-4-10-9-11-13(20-8-7-17-12(20)5-2)18-15(16-6-3)19-14(11)21-10/h7-9H,4-6H2,1-3H3,(H,16,18,19).
What are the key properties of N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine?
N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine has a molecular weight of 301.42 g/mol, XLogP of 3.43, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103331057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).