(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol

C11H17NOS — CID 69207760

IUPAC(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol
SMILESCN1CCCCC1C(O)c1ccsc1
InChIInChI=1S/C11H17NOS/c1-12-6-3-2-4-10(12)11(13)9-5-7-14-8-9/h5,7-8,10-11,13H,2-4,6H2,1H3
InChIKeyPJTAWKMNSTUGES-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.27
Rot. Bonds2

About (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol

(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol (PubChem CID 69207760) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol.

Molecular Properties

Compound Name(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol
PubChem CID69207760
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol
SMILESCN1CCCCC1C(O)c1ccsc1
InChIInChI=1S/C11H17NOS/c1-12-6-3-2-4-10(12)11(13)9-5-7-14-8-9/h5,7-8,10-11,13H,2-4,6H2,1H3
InChIKeyPJTAWKMNSTUGES-UHFFFAOYSA-N
XLogP2.27
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol?
The IUPAC name of (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol (CID 69207760) is (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol.
What is the SMILES notation for (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol?
The canonical SMILES for (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol is CN1CCCCC1C(O)c1ccsc1.
What is the InChIKey of (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol?
The InChIKey is PJTAWKMNSTUGES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-12-6-3-2-4-10(12)11(13)9-5-7-14-8-9/h5,7-8,10-11,13H,2-4,6H2,1H3.
What are the key properties of (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol?
(1-methylpiperidin-2-yl)-thiophen-3-ylmethanol has a molecular weight of 211.33 g/mol, XLogP of 2.27, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-methylpiperidin-2-yl)-thiophen-3-ylmethanol is sourced from PubChem (CID 69207760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).