2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol

C14H19N3OS — CID 102687014

IUPAC2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESCc1csc2c(N3CCCCC3CCO)ncnc12
InChIInChI=1S/C14H19N3OS/c1-10-8-19-13-12(10)15-9-16-14(13)17-6-3-2-4-11(17)5-7-18/h8-9,11,18H,2-7H2,1H3
InChIKeyWDTAMYNHFXIEEK-UHFFFAOYSA-N
MW277.39 g/mol
LogP2.74
Rot. Bonds3

About 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol

2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol (PubChem CID 102687014) has the molecular formula C14H19N3OS and a molecular weight of 277.39 g/mol. Its IUPAC name is 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol.

Molecular Properties

Compound Name2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol
PubChem CID102687014
Molecular FormulaC14H19N3OS
Molecular Weight277.39 g/mol
Exact Mass277.12
IUPAC Name2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol
SMILESCc1csc2c(N3CCCCC3CCO)ncnc12
InChIInChI=1S/C14H19N3OS/c1-10-8-19-13-12(10)15-9-16-14(13)17-6-3-2-4-11(17)5-7-18/h8-9,11,18H,2-7H2,1H3
InChIKeyWDTAMYNHFXIEEK-UHFFFAOYSA-N
XLogP2.74
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.39
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]methanamine
CID 102686844
N-[[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)pyrrolidin-2-yl]methyl]propan-1-amine
CID 102687184
2-[(2S)-1-thieno[2,3-d]pyrimidin-4-ylpiperidin-2-yl]ethanol
CID 8008870
3-methyl-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-2-carboxylic acid
CID 107070339
2-[1-(3-methylpyrazin-2-yl)piperidin-2-yl]ethanol
CID 83064794
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidine-3-carboxylic acid
CID 102685906
[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)azetidin-3-yl]methanol
CID 102687035
1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-4-ol
CID 102687010
2-[4-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperazin-1-yl]ethanol
CID 102687009
2-[1-(6-amino-5-propan-2-ylpyrimidin-4-yl)piperidin-2-yl]ethanol
CID 80767375
(3R,4R)-4-(hydroxymethyl)-1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-3-ol
CID 56898903
4-(4-butylpiperidin-1-yl)-7-methylthieno[3,2-d]pyrimidine
CID 23381410

Frequently Asked Questions

What is the IUPAC name of 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol?
The IUPAC name of 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol (CID 102687014) is 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol.
What is the SMILES notation for 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol?
The canonical SMILES for 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol is Cc1csc2c(N3CCCCC3CCO)ncnc12.
What is the InChIKey of 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol?
The InChIKey is WDTAMYNHFXIEEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3OS/c1-10-8-19-13-12(10)15-9-16-14(13)17-6-3-2-4-11(17)5-7-18/h8-9,11,18H,2-7H2,1H3.
What are the key properties of 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol?
2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol has a molecular weight of 277.39 g/mol, XLogP of 2.74, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(7-methylthieno[3,2-d]pyrimidin-4-yl)piperidin-2-yl]ethanol is sourced from PubChem (CID 102687014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).