6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine

C13H19N5S — CID 70536376

IUPAC6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1sc2nc(N3CCNCC3)nc(N)c2c1C
InChIInChI=1S/C13H19N5S/c1-3-9-8(2)10-11(14)16-13(17-12(10)19-9)18-6-4-15-5-7-18/h15H,3-7H2,1-2H3,(H2,14,16,17)
InChIKeyGRBUZNJTBXHHAW-UHFFFAOYSA-N
MW277.40 g/mol
LogP1.55
Rot. Bonds2

About 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine

6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine (PubChem CID 70536376) has the molecular formula C13H19N5S and a molecular weight of 277.40 g/mol. Its IUPAC name is 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
PubChem CID70536376
Molecular FormulaC13H19N5S
Molecular Weight277.40 g/mol
Exact Mass277.14
IUPAC Name6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine
SMILESCCc1sc2nc(N3CCNCC3)nc(N)c2c1C
InChIInChI=1S/C13H19N5S/c1-3-9-8(2)10-11(14)16-13(17-12(10)19-9)18-6-4-15-5-7-18/h15H,3-7H2,1-2H3,(H2,14,16,17)
InChIKeyGRBUZNJTBXHHAW-UHFFFAOYSA-N
XLogP1.55
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.40
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5,6-Dimethylthieno(2,3-d)pyrimidin-4-amine
CID 290232
5,6,7,8-Tetrahydrobenzo(4,5)thieno(2,3-d)pyrimidin-4-amine
CID 258149
2,7-Dimethyl-4-(piperazin-1-yl)-5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidine
CID 3207225
4-(4-(5,5-Dimethyl-4,5-dihydrothiazol-2-yl)piperazin-1-yl)-6-propylthieno[2,3-d]pyrimidine
CID 54765302
4-N,4-N-dimethyl-1-N-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(12),2(6),8,10-tetraen-12-yl)cyclohexane-1,4-diamine
CID 57519811
6-Methyl-4-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
CID 3157193
4-[4-(5,5-Dimethyl-4,5-Dihydro-1,3-Thiazol-2-Yl)piperazin-1-Yl]-6-(2-Fluoroethyl)thieno[2,3-D]pyrimidine
CID 91864570
7-Methyl-2-(prop-2-en-1-ylsulfanyl)-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
CID 2006142
3-(7-Methyl-2-methylsulfanyl-5,6,7,8-tetrahydro-pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-ylamino)-propa n-1-ol
CID 2009708
2-Methyl-4-piperazin-1-yl-5,6,7,8-tetrahydro-benzo[4,5]thieno[2,3-d]pyrimidine
CID 2047262
2-Methyl-4-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine
CID 2047299
2-[[4-(ethylamino)-7-methyl-6,8-dihydro-5H-pyrido[4,5]thieno[1,2-c]pyrimidin-2-yl]sulfanyl]acetamide
CID 2817154

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine (CID 70536376) is 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine is CCc1sc2nc(N3CCNCC3)nc(N)c2c1C.
What is the InChIKey of 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
The InChIKey is GRBUZNJTBXHHAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5S/c1-3-9-8(2)10-11(14)16-13(17-12(10)19-9)18-6-4-15-5-7-18/h15H,3-7H2,1-2H3,(H2,14,16,17).
What are the key properties of 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine?
6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine has a molecular weight of 277.40 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-5-methyl-2-piperazin-1-ylthieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 70536376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).