6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine

C15H23N5S — CID 63266258

IUPAC6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N(C)CCN3CCNCC3)ncnc2s1
InChIInChI=1S/C15H23N5S/c1-3-12-10-13-14(17-11-18-15(13)21-12)19(2)8-9-20-6-4-16-5-7-20/h10-11,16H,3-9H2,1-2H3
InChIKeyZKWSWCYGGFKXON-UHFFFAOYSA-N
MW305.45 g/mol
LogP1.60
Rot. Bonds5

About 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine

6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine (PubChem CID 63266258) has the molecular formula C15H23N5S and a molecular weight of 305.45 g/mol. Its IUPAC name is 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine.

Molecular Properties

Compound Name6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine
PubChem CID63266258
Molecular FormulaC15H23N5S
Molecular Weight305.45 g/mol
Exact Mass305.17
IUPAC Name6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine
SMILESCCc1cc2c(N(C)CCN3CCNCC3)ncnc2s1
InChIInChI=1S/C15H23N5S/c1-3-12-10-13-14(17-11-18-15(13)21-12)19(2)8-9-20-6-4-16-5-7-20/h10-11,16H,3-9H2,1-2H3
InChIKeyZKWSWCYGGFKXON-UHFFFAOYSA-N
XLogP1.60
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.45
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Ddp-225
CID 6918194
1-{Thieno[2,3-d]pyrimidin-4-yl}piperazine
CID 16768198
4-Benzyl-1-(thieno(2,3-d)pyrimidin-4-yl)piperidine
CID 2100018
4-(4-(5,5-Dimethyl-4,5-dihydrothiazol-2-yl)piperazin-1-yl)-6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidine
CID 72201086
4-(4-(5,5-Dimethyl-4,5-dihydrothiazol-2-yl)piperazin-1-yl)-6-propylthieno[2,3-d]pyrimidine
CID 54765302
4-{4-[5-(Difluoromethyl)-1,3,4-Thiadiazol-2-Yl]piperazin-1-Yl}-6-(2,2,2-Trifluoroethyl)thieno[2,3-D]pyrimidine
CID 86297462
6-(2,2,2-Trifluoroethyl)-4-{4-[5-(Trifluoromethyl)-1,3,4-Thiadiazol-2-Yl]piperazin-1-Yl}thieno[2,3-D]pyrimidine
CID 86297465
4-[4-(5-Methyl-1,3,4-Thiadiazol-2-Yl)piperazin-1-Yl]-6-(2,2,2-Trifluoroethyl)thieno[2,3-D]pyrimidine
CID 90453086
4-[4-(5,5-Dimethyl-4,5-Dihydro-1,3-Thiazol-2-Yl)piperazin-1-Yl]-6-(Pentafluoroethyl)thieno[2,3-D]pyrimidine
CID 90453135
6-Methyl-4-(4-methylpiperazin-1-yl)-5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidine
CID 3157193
N,N-diethyl-N'-[5-(4-fluorophenyl)thieno[2,3-d]pyrimidin-4-yl]propane-1,3-diamine
CID 1608673
N-benzylthieno[2,3-d]pyrimidin-4-amine
CID 2139597

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The IUPAC name of 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine (CID 63266258) is 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine.
What is the SMILES notation for 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The canonical SMILES for 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine is CCc1cc2c(N(C)CCN3CCNCC3)ncnc2s1.
What is the InChIKey of 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
The InChIKey is ZKWSWCYGGFKXON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5S/c1-3-12-10-13-14(17-11-18-15(13)21-12)19(2)8-9-20-6-4-16-5-7-20/h10-11,16H,3-9H2,1-2H3.
What are the key properties of 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine?
6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine has a molecular weight of 305.45 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-N-methyl-N-(2-piperazin-1-ylethyl)thieno[2,3-d]pyrimidin-4-amine is sourced from PubChem (CID 63266258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).