2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine

C15H24N4S — CID 103325641

IUPAC2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCNc1nc(N(C)CCC(C)C)c2cc(C)sc2n1
InChIInChI=1S/C15H24N4S/c1-6-16-15-17-13(19(5)8-7-10(2)3)12-9-11(4)20-14(12)18-15/h9-10H,6-8H2,1-5H3,(H,16,17,18)
InChIKeyFAKVFISHARNKTE-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.91
Rot. Bonds6

About 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine

2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103325641) has the molecular formula C15H24N4S and a molecular weight of 292.45 g/mol. Its IUPAC name is 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103325641
Molecular FormulaC15H24N4S
Molecular Weight292.45 g/mol
Exact Mass292.17
IUPAC Name2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
SMILESCCNc1nc(N(C)CCC(C)C)c2cc(C)sc2n1
InChIInChI=1S/C15H24N4S/c1-6-16-15-17-13(19(5)8-7-10(2)3)12-9-11(4)20-14(12)18-15/h9-10H,6-8H2,1-5H3,(H,16,17,18)
InChIKeyFAKVFISHARNKTE-UHFFFAOYSA-N
XLogP3.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-methylamino]propan-1-ol
CID 103329881
2-N-ethyl-4-N-(1-methoxypropan-2-yl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325816
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-methylamino]-N-methylacetamide
CID 103324793
2-N,4-N-diethyl-6-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324589
4-N-[1-(dimethylamino)propan-2-yl]-2-N-ethyl-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329470
4-N,6-dimethyl-4-N-(2-methylsulfanylethyl)-2-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329651
2-N-ethyl-4-N-(furan-2-ylmethyl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324905
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol
CID 103325631
4-N-[2-(dimethylamino)ethyl]-2-N,6-diethyl-4-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103327863
N-ethyl-6-methyl-4-propan-2-yloxythieno[2,3-d]pyrimidin-2-amine
CID 103331498
2-N,6-dimethyl-4-N,4-N-bis(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325508
4-N-(3,3-dimethylbutan-2-yl)-2-N-ethyl-6-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103329938

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine (CID 103325641) is 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine is CCNc1nc(N(C)CCC(C)C)c2cc(C)sc2n1.
What is the InChIKey of 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is FAKVFISHARNKTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4S/c1-6-16-15-17-13(19(5)8-7-10(2)3)12-9-11(4)20-14(12)18-15/h9-10H,6-8H2,1-5H3,(H,16,17,18).
What are the key properties of 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine?
2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 292.45 g/mol, XLogP of 3.91, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103325641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).