2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

C11H15N3OS — CID 6460527

IUPAC2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESCCc1cc2c(NCCO)nc(C)nc2s1
InChIInChI=1S/C11H15N3OS/c1-3-8-6-9-10(12-4-5-15)13-7(2)14-11(9)16-8/h6,15H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyVXMGUKNRCOQQIM-UHFFFAOYSA-N
MW237.33 g/mol
LogP1.97
Rot. Bonds4

About 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol

2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (PubChem CID 6460527) has the molecular formula C11H15N3OS and a molecular weight of 237.33 g/mol. Its IUPAC name is 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.

Molecular Properties

Compound Name2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
PubChem CID6460527
Molecular FormulaC11H15N3OS
Molecular Weight237.33 g/mol
Exact Mass237.09
IUPAC Name2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
SMILESCCc1cc2c(NCCO)nc(C)nc2s1
InChIInChI=1S/C11H15N3OS/c1-3-8-6-9-10(12-4-5-15)13-7(2)14-11(9)16-8/h6,15H,3-5H2,1-2H3,(H,12,13,14)
InChIKeyVXMGUKNRCOQQIM-UHFFFAOYSA-N
XLogP1.97
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.33
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]propanoic acid
CID 654691
2-[(6-ethyl-2-hydrazinylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 103335072
1-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]propan-2-ol
CID 82022327
2-[(6-ethyl-2-pyridin-3-ylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol
CID 91965311
1-[4-[6-ethyl-4-(2-hydroxyethylamino)thieno[2,3-d]pyrimidin-2-yl]piperazin-1-yl]ethanone
CID 70536398
2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide
CID 39085002
6-ethyl-2-methyl-N-(pyridin-2-ylmethyl)thieno[2,3-d]pyrimidin-4-amine
CID 6458164
2-[2-[[6-ethyl-2-(ethylamino)thieno[2,3-d]pyrimidin-4-yl]amino]ethoxy]ethanol
CID 103327253
6-ethyl-2-N-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324044
2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]-N-methyl-N-phenylacetamide
CID 39081926
5-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]benzene-1,3-dicarboxylic acid
CID 28853946
3-[[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]methyl]-1H-pyridazin-6-one
CID 138029991

Frequently Asked Questions

What is the IUPAC name of 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The IUPAC name of 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol (CID 6460527) is 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol.
What is the SMILES notation for 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The canonical SMILES for 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is CCc1cc2c(NCCO)nc(C)nc2s1.
What is the InChIKey of 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
The InChIKey is VXMGUKNRCOQQIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3OS/c1-3-8-6-9-10(12-4-5-15)13-7(2)14-11(9)16-8/h6,15H,3-5H2,1-2H3,(H,12,13,14).
What are the key properties of 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol?
2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol has a molecular weight of 237.33 g/mol, XLogP of 1.97, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-ethyl-2-methylthieno[2,3-d]pyrimidin-4-yl)amino]ethanol is sourced from PubChem (CID 6460527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).