2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine

C13H19N3OS — CID 116775396

IUPAC2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCC(C)(OC)c1nc(N)c2c(C)c(C)sc2n1
InChIInChI=1S/C13H19N3OS/c1-6-13(4,17-5)12-15-10(14)9-7(2)8(3)18-11(9)16-12/h6H2,1-5H3,(H2,14,15,16)
InChIKeyZDBWVKAVLGKPSC-UHFFFAOYSA-N
MW265.38 g/mol
LogP3.16
Rot. Bonds3

About 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine

2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 116775396) has the molecular formula C13H19N3OS and a molecular weight of 265.38 g/mol. Its IUPAC name is 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
PubChem CID116775396
Molecular FormulaC13H19N3OS
Molecular Weight265.38 g/mol
Exact Mass265.12
IUPAC Name2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
SMILESCCC(C)(OC)c1nc(N)c2c(C)c(C)sc2n1
InChIInChI=1S/C13H19N3OS/c1-6-13(4,17-5)12-15-10(14)9-7(2)8(3)18-11(9)16-12/h6H2,1-5H3,(H2,14,15,16)
InChIKeyZDBWVKAVLGKPSC-UHFFFAOYSA-N
XLogP3.16
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine with MolForge

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Related Compounds

5-bromo-6-ethyl-2-(2-methoxybutan-2-yl)pyrimidin-4-amine
CID 116776732
2-(chloromethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 9115252
2-(2-methoxybutan-2-yl)-5,7-dihydrothieno[3,4-d]pyrimidin-4-amine
CID 116777321
5,6-dimethyl-2-(2-methylpropyl)thieno[2,3-d]pyrimidin-4-amine
CID 61026333
1-[(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)methyl-ethylamino]-2-methylpropan-2-ol
CID 79379457
5,6-dimethyl-2-(pentoxymethyl)thieno[2,3-d]pyrimidin-4-amine
CID 55044935
ethyl 4-amino-2-(2-methoxybutan-2-yl)pyrimidine-5-carboxylate
CID 116782890
4-(4-amino-5,6-dimethylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-methylbutan-2-ol
CID 111537082
4-chloro-2-(3-ethoxypentan-3-yl)-5,6-dimethylthieno[2,3-d]pyrimidine
CID 116740151
2-(butylsulfanylmethyl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 60701127
5,6-dimethyl-2-(2-methylcyclopropyl)thieno[2,3-d]pyrimidin-4-amine
CID 65419572
2-[(1S)-1-chloroethyl]-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine
CID 40973732

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine (CID 116775396) is 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine is CCC(C)(OC)c1nc(N)c2c(C)c(C)sc2n1.
What is the InChIKey of 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is ZDBWVKAVLGKPSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3OS/c1-6-13(4,17-5)12-15-10(14)9-7(2)8(3)18-11(9)16-12/h6H2,1-5H3,(H2,14,15,16).
What are the key properties of 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine?
2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 265.38 g/mol, XLogP of 3.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxybutan-2-yl)-5,6-dimethylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 116775396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).