2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide

C18H25N3OS2 — CID 8521681

IUPAC2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide
SMILESCCc1cc2c(SCC(=O)N(C)C3CCC(C)CC3)ncnc2s1
InChIInChI=1S/C18H25N3OS2/c1-4-14-9-15-17(19-11-20-18(15)24-14)23-10-16(22)21(3)13-7-5-12(2)6-8-13/h9,11-13H,4-8,10H2,1-3H3
InChIKeyZNSOMVNRCPXUQT-UHFFFAOYSA-N
MW363.55 g/mol
LogP4.38
Rot. Bonds5

About 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide

2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide (PubChem CID 8521681) has the molecular formula C18H25N3OS2 and a molecular weight of 363.55 g/mol. Its IUPAC name is 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide.

Molecular Properties

Compound Name2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide
PubChem CID8521681
Molecular FormulaC18H25N3OS2
Molecular Weight363.55 g/mol
Exact Mass363.14
IUPAC Name2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide
SMILESCCc1cc2c(SCC(=O)N(C)C3CCC(C)CC3)ncnc2s1
InChIInChI=1S/C18H25N3OS2/c1-4-14-9-15-17(19-11-20-18(15)24-14)23-10-16(22)21(3)13-7-5-12(2)6-8-13/h9,11-13H,4-8,10H2,1-3H3
InChIKeyZNSOMVNRCPXUQT-UHFFFAOYSA-N
XLogP4.38
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.55
LogP ≤ 54.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclohexyl-2-(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methylacetamide
CID 39075427
N-cyclopropyl-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 9265700
1-(4-chlorophenyl)-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone
CID 696855
N-cyclohexyl-2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methylacetamide
CID 865963
1-(4-benzylpiperidin-1-yl)-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylethanone
CID 2417436
2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(2,4,4-trimethylpentan-2-yl)acetamide
CID 8570411
3-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-1-piperazin-1-ylpropan-1-one
CID 39162008
N-methyl-N-(4-methylcyclohexyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 39952566
2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(2-morpholin-4-ylethyl)acetamide
CID 39083157
N-[(1R)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethyl]-2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetamide
CID 9440058
2-[(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]isoindole-1,3-dione
CID 4826571
N-[[5-[2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanylacetyl]thiophen-2-yl]methyl]acetamide
CID 8521680

Frequently Asked Questions

What is the IUPAC name of 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide?
The IUPAC name of 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide (CID 8521681) is 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide.
What is the SMILES notation for 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide?
The canonical SMILES for 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide is CCc1cc2c(SCC(=O)N(C)C3CCC(C)CC3)ncnc2s1.
What is the InChIKey of 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide?
The InChIKey is ZNSOMVNRCPXUQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3OS2/c1-4-14-9-15-17(19-11-20-18(15)24-14)23-10-16(22)21(3)13-7-5-12(2)6-8-13/h9,11-13H,4-8,10H2,1-3H3.
What are the key properties of 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide?
2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide has a molecular weight of 363.55 g/mol, XLogP of 4.38, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-ethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-methyl-N-(4-methylcyclohexyl)acetamide is sourced from PubChem (CID 8521681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).