2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol

C14H22N4OS — CID 103325631

IUPAC2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol
SMILESCCCN(CCO)c1nc(NCC)nc2sc(C)cc12
InChIInChI=1S/C14H22N4OS/c1-4-6-18(7-8-19)12-11-9-10(3)20-13(11)17-14(16-12)15-5-2/h9,19H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyPCOVXLSLWPRWLY-UHFFFAOYSA-N
MW294.42 g/mol
LogP2.64
Rot. Bonds7

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

2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol (PubChem CID 103325631) has the molecular formula C14H22N4OS and a molecular weight of 294.42 g/mol. Its IUPAC name is 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol.

Molecular Properties

Compound Name2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol
PubChem CID103325631
Molecular FormulaC14H22N4OS
Molecular Weight294.42 g/mol
Exact Mass294.15
IUPAC Name2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol
SMILESCCCN(CCO)c1nc(NCC)nc2sc(C)cc12
InChIInChI=1S/C14H22N4OS/c1-4-6-18(7-8-19)12-11-9-10(3)20-13(11)17-14(16-12)15-5-2/h9,19H,4-8H2,1-3H3,(H,15,16,17)
InChIKeyPCOVXLSLWPRWLY-UHFFFAOYSA-N
XLogP2.64
TPSA61.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.42
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-N,4-N-diethyl-6-methyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103324589
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]ethanol
CID 103324005
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-methylamino]propan-1-ol
CID 103329881
2-[[6-ethyl-2-(methylamino)thieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol
CID 103325635
2-N-ethyl-4-N,6-dimethyl-4-N-(3-methylbutyl)thieno[2,3-d]pyrimidine-2,4-diamine
CID 103325641
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-methylamino]-N-methylacetamide
CID 103324793
4-N-(cyclopropylmethyl)-2-N,6-dimethyl-4-N-propylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325739
2-N-ethyl-4-N-(1-methoxypropan-2-yl)-4-N,6-dimethylthieno[2,3-d]pyrimidine-2,4-diamine
CID 103325816
2-[3-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]amino]propoxy]ethanol
CID 106311471
2-[(2-amino-6-ethylthieno[2,3-d]pyrimidin-4-yl)-propylamino]ethanol
CID 103325630
3-[[6-methyl-2-(propylamino)thieno[2,3-d]pyrimidin-4-yl]amino]propan-1-ol
CID 103324486
2-[[2-(ethylamino)-7H-purin-6-yl]-propylamino]ethanol
CID 114784127

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol?
The IUPAC name of 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol (CID 103325631) is 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol.
What is the SMILES notation for 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol?
The canonical SMILES for 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol is CCCN(CCO)c1nc(NCC)nc2sc(C)cc12.
What is the InChIKey of 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol?
The InChIKey is PCOVXLSLWPRWLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4OS/c1-4-6-18(7-8-19)12-11-9-10(3)20-13(11)17-14(16-12)15-5-2/h9,19H,4-8H2,1-3H3,(H,15,16,17).
What are the key properties of 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol?
2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol has a molecular weight of 294.42 g/mol, XLogP of 2.64, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(ethylamino)-6-methylthieno[2,3-d]pyrimidin-4-yl]-propylamino]ethanol is sourced from PubChem (CID 103325631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).