4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine

C15H24N4S — CID 103326567

IUPAC4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCNc1nc(N(C)C(C)C(C)(C)C)c2cc(C)sc2n1
InChIInChI=1S/C15H24N4S/c1-9-8-11-12(19(7)10(2)15(3,4)5)17-14(16-6)18-13(11)20-9/h8,10H,1-7H3,(H,16,17,18)
InChIKeyNVCVZOBDKKBCSH-UHFFFAOYSA-N
MW292.45 g/mol
LogP3.91
Rot. Bonds3

About 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine

4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine (PubChem CID 103326567) has the molecular formula C15H24N4S and a molecular weight of 292.45 g/mol. Its IUPAC name is 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine.

Molecular Properties

Compound Name4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine
PubChem CID103326567
Molecular FormulaC15H24N4S
Molecular Weight292.45 g/mol
Exact Mass292.17
IUPAC Name4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine
SMILESCNc1nc(N(C)C(C)C(C)(C)C)c2cc(C)sc2n1
InChIInChI=1S/C15H24N4S/c1-9-8-11-12(19(7)10(2)15(3,4)5)17-14(16-6)18-13(11)20-9/h8,10H,1-7H3,(H,16,17,18)
InChIKeyNVCVZOBDKKBCSH-UHFFFAOYSA-N
XLogP3.91
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
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 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine with MolForge

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Related Compounds

2-N,6-dimethyl-4-N,4-N-bis(2-methylpropyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325508
2-hydrazinyl-N,6-dimethyl-N-propan-2-ylthieno[2,3-d]pyrimidin-4-amine
CID 103335021
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-methylamino]propan-1-ol
CID 103329881
4-N-ethyl-2-N,6-dimethyl-4-N-(2-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103328905
2-[methyl-[6-methyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]amino]-N-propan-2-ylacetamide
CID 103326513
2-N-ethyl-4-N-(1-methoxypropan-2-yl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325816
2-N,4-N,6-trimethyl-4-N-(2-pyrrolidin-1-ylethyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103327610
N,6-dimethyl-4-(1,1,1-trifluoropropan-2-yloxy)thieno[2,3-d]pyrimidin-2-amine
CID 103332952
4-methoxy-N,6-dimethylthieno[2,3-d]pyrimidin-2-amine
CID 103331394
4-N-(3,3-dimethylbutan-2-yl)-2-N-ethyl-4-N-methylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103326563
4-N-butan-2-yl-2-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324085
2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325641

Frequently Asked Questions

What is the IUPAC name of 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine?
The IUPAC name of 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine (CID 103326567) is 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine.
What is the SMILES notation for 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine?
The canonical SMILES for 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine is CNc1nc(N(C)C(C)C(C)(C)C)c2cc(C)sc2n1.
What is the InChIKey of 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine?
The InChIKey is NVCVZOBDKKBCSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4S/c1-9-8-11-12(19(7)10(2)15(3,4)5)17-14(16-6)18-13(11)20-9/h8,10H,1-7H3,(H,16,17,18).
What are the key properties of 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine?
4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine has a molecular weight of 292.45 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3,3-dimethylbutan-2-yl)-2-N,4-N,6-trimethylthieno[2,3-d]pyrimidine-2,4-diamine is sourced from PubChem (CID 103326567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).