4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine

C16H24N4S — CID 103327611

IUPAC4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(N2CCCC2(C)C)c2cc(CC)sc2n1
InChIInChI=1S/C16H24N4S/c1-5-11-10-12-13(20-9-7-8-16(20,3)4)18-15(17-6-2)19-14(12)21-11/h10H,5-9H2,1-4H3,(H,17,18,19)
InChIKeyXWIFYVLEHDIHJD-UHFFFAOYSA-N
MW304.46 g/mol
LogP4.06
Rot. Bonds4

About 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine

4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine (PubChem CID 103327611) has the molecular formula C16H24N4S and a molecular weight of 304.46 g/mol. Its IUPAC name is 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine.

Molecular Properties

Compound Name4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
PubChem CID103327611
Molecular FormulaC16H24N4S
Molecular Weight304.46 g/mol
Exact Mass304.17
IUPAC Name4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
SMILESCCNc1nc(N2CCCC2(C)C)c2cc(CC)sc2n1
InChIInChI=1S/C16H24N4S/c1-5-11-10-12-13(20-9-7-8-16(20,3)4)18-15(17-6-2)19-14(12)21-11/h10H,5-9H2,1-4H3,(H,17,18,19)
InChIKeyXWIFYVLEHDIHJD-UHFFFAOYSA-N
XLogP4.06
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.46
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,6-diethyl-4-(3-methylthiomorpholin-4-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103328077
N,6-diethyl-4-(2-ethylimidazol-1-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103331057
4-(4-chloropyrazol-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine
CID 103331015
[1-[[[6-ethyl-2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]methyl]cyclopropyl]methanol
CID 103329341
4-N-(2,2-dimethylbutyl)-2-N,6-diethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103466672
4-(2,2-dimethylmorpholin-4-yl)-N-ethyl-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103325205
4-(azepan-1-yl)-N-ethyl-6-methylthieno[2,3-d]pyrimidin-2-amine
CID 103323872
N-ethyl-6-methyl-4-(1,4-oxazepan-4-yl)thieno[2,3-d]pyrimidin-2-amine
CID 103327476
4-(2,2-dimethylpyrrolidin-1-yl)-N-methylthieno[2,3-d]pyrimidin-2-amine
CID 103327615
4-N-cyclopropyl-2-N,6-diethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324607
[4-(3,4-dimethylpyrrolidin-1-yl)-6-ethylthieno[2,3-d]pyrimidin-2-yl]hydrazine
CID 103334491
4-N-[2-(dimethylamino)ethyl]-2-N,6-diethyl-4-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103327863

Frequently Asked Questions

What is the IUPAC name of 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine?
The IUPAC name of 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine (CID 103327611) is 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine.
What is the SMILES notation for 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine?
The canonical SMILES for 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine is CCNc1nc(N2CCCC2(C)C)c2cc(CC)sc2n1.
What is the InChIKey of 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine?
The InChIKey is XWIFYVLEHDIHJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4S/c1-5-11-10-12-13(20-9-7-8-16(20,3)4)18-15(17-6-2)19-14(12)21-11/h10H,5-9H2,1-4H3,(H,17,18,19).
What are the key properties of 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine?
4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine has a molecular weight of 304.46 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,2-dimethylpyrrolidin-1-yl)-N,6-diethylthieno[2,3-d]pyrimidin-2-amine is sourced from PubChem (CID 103327611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).