2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol

C12H19NOS — CID 121200335

IUPAC2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol
SMILESOCCC1CCN(Cc2ccsc2)CC1
InChIInChI=1S/C12H19NOS/c14-7-3-11-1-5-13(6-2-11)9-12-4-8-15-10-12/h4,8,10-11,14H,1-3,5-7,9H2
InChIKeyDRHVMZSBZCPNQJ-UHFFFAOYSA-N
MW225.36 g/mol
LogP2.34
Rot. Bonds4

About 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol

2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol (PubChem CID 121200335) has the molecular formula C12H19NOS and a molecular weight of 225.36 g/mol. Its IUPAC name is 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol.

Molecular Properties

Compound Name2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol
PubChem CID121200335
Molecular FormulaC12H19NOS
Molecular Weight225.36 g/mol
Exact Mass225.12
IUPAC Name2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol
SMILESOCCC1CCN(Cc2ccsc2)CC1
InChIInChI=1S/C12H19NOS/c14-7-3-11-1-5-13(6-2-11)9-12-4-8-15-10-12/h4,8,10-11,14H,1-3,5-7,9H2
InChIKeyDRHVMZSBZCPNQJ-UHFFFAOYSA-N
XLogP2.34
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.36
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[(3R)-1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanol
CID 129367813
1-[4-(2-hydroxyethyl)piperidin-1-yl]-2-thiophen-3-ylethanone
CID 121200714
4-(bromomethyl)-1-(thiophen-3-ylmethyl)azepane
CID 131162358
[1-(thiophen-3-ylmethyl)pyrrolidin-3-yl]methanamine
CID 62068989
2-[4-(hydroxymethyl)piperidin-1-yl]-1-[4-(thiophen-3-ylmethyl)piperazin-1-yl]ethanone
CID 110899410
1-(thiophen-3-ylmethyl)pyrrolidin-3-ol
CID 62916311
1-(thiophen-3-ylmethyl)azetidine
CID 131087701
2-methoxy-N-[[1-(thiophen-3-ylmethyl)piperidin-4-yl]methyl]ethanamine
CID 62592940
1-tert-butyl-3-[[1-(thiophen-3-ylmethyl)piperidin-4-yl]methyl]urea
CID 121057602
3-bromo-1-(thiophen-3-ylmethyl)pyrrolidine
CID 80675822
N-[[1-(thiophen-3-ylmethyl)piperidin-4-yl]methyl]butanamide
CID 121057584
2-[1-[(3,4-dichlorophenyl)methyl]piperidin-4-yl]ethanol
CID 10637061

Frequently Asked Questions

What is the IUPAC name of 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol?
The IUPAC name of 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol (CID 121200335) is 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol.
What is the SMILES notation for 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol?
The canonical SMILES for 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol is OCCC1CCN(Cc2ccsc2)CC1.
What is the InChIKey of 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol?
The InChIKey is DRHVMZSBZCPNQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NOS/c14-7-3-11-1-5-13(6-2-11)9-12-4-8-15-10-12/h4,8,10-11,14H,1-3,5-7,9H2.
What are the key properties of 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol?
2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol has a molecular weight of 225.36 g/mol, XLogP of 2.34, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(thiophen-3-ylmethyl)piperidin-4-yl]ethanol is sourced from PubChem (CID 121200335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).