6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine

C13H14N6S — CID 114783590

IUPAC6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine
SMILESCNc1nc(N2CCc3sccc3C2)c2[nH]cnc2n1
InChIInChI=1S/C13H14N6S/c1-14-13-17-11-10(15-7-16-11)12(18-13)19-4-2-9-8(6-19)3-5-20-9/h3,5,7H,2,4,6H2,1H3,(H2,14,15,16,17,18)
InChIKeyGCMYTMXPROEQQF-UHFFFAOYSA-N
MW286.36 g/mol
LogP2.02
Rot. Bonds2

About 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine

6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine (PubChem CID 114783590) has the molecular formula C13H14N6S and a molecular weight of 286.36 g/mol. Its IUPAC name is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine.

Molecular Properties

Compound Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine
PubChem CID114783590
Molecular FormulaC13H14N6S
Molecular Weight286.36 g/mol
Exact Mass286.10
IUPAC Name6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine
SMILESCNc1nc(N2CCc3sccc3C2)c2[nH]cnc2n1
InChIInChI=1S/C13H14N6S/c1-14-13-17-11-10(15-7-16-11)12(18-13)19-4-2-9-8(6-19)3-5-20-9/h3,5,7H,2,4,6H2,1H3,(H2,14,15,16,17,18)
InChIKeyGCMYTMXPROEQQF-UHFFFAOYSA-N
XLogP2.02
TPSA69.73 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.36
LogP ≤ 52.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine with MolForge

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Related Compounds

4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-fluoro-N-methylpyrimidin-2-amine
CID 80764971
6-(azocan-1-yl)-N-methyl-7H-purin-2-amine
CID 114783608
3-methyl-1-[2-(methylamino)-7H-purin-6-yl]pyrrolidin-3-ol
CID 103358836
6-(1,1-dioxo-1,4-thiazinan-4-yl)-N-methyl-7H-purin-2-amine
CID 114783973
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-iodo-1H-pyrimidin-6-one
CID 136993973
6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-5-ethyl-N-methylpyrimidin-4-amine
CID 80764105
6-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-N-methyl-7H-purin-2-amine
CID 114785462
6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-N-methyl-7H-purin-2-amine
CID 114785647
2-N-methyl-6-N-(4-methylpiperazin-1-yl)-7H-purine-2,6-diamine
CID 114785912
4-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)thieno[3,2-d]pyrimidine
CID 24607532
1-[2-(ethylamino)-7H-purin-6-yl]-1,4-diazepan-5-one
CID 114785109
[6-methyl-4-[2-(methylamino)-7H-purin-6-yl]morpholin-2-yl]methanol
CID 102939050

Frequently Asked Questions

What is the IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine?
The IUPAC name of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine (CID 114783590) is 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine.
What is the SMILES notation for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine?
The canonical SMILES for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine is CNc1nc(N2CCc3sccc3C2)c2[nH]cnc2n1.
What is the InChIKey of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine?
The InChIKey is GCMYTMXPROEQQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N6S/c1-14-13-17-11-10(15-7-16-11)12(18-13)19-4-2-9-8(6-19)3-5-20-9/h3,5,7H,2,4,6H2,1H3,(H2,14,15,16,17,18).
What are the key properties of 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine?
6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine has a molecular weight of 286.36 g/mol, XLogP of 2.02, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,7-dihydro-4H-thieno[3,2-c]pyridin-5-yl)-N-methyl-7H-purin-2-amine is sourced from PubChem (CID 114783590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).