1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol

C11H17NOS — CID 130834241

IUPAC1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol
SMILESCC1CN(C)CCC1(O)c1cccs1
InChIInChI=1S/C11H17NOS/c1-9-8-12(2)6-5-11(9,13)10-4-3-7-14-10/h3-4,7,9,13H,5-6,8H2,1-2H3
InChIKeyFUZOZOGPFWJJIQ-UHFFFAOYSA-N
MW211.33 g/mol
LogP1.91
Rot. Bonds1

About 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol

1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol (PubChem CID 130834241) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol
PubChem CID130834241
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol
SMILESCC1CN(C)CCC1(O)c1cccs1
InChIInChI=1S/C11H17NOS/c1-9-8-12(2)6-5-11(9,13)10-4-3-7-14-10/h3-4,7,9,13H,5-6,8H2,1-2H3
InChIKeyFUZOZOGPFWJJIQ-UHFFFAOYSA-N
XLogP1.91
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-3-thiophen-2-ylpyrrolidin-3-ol
CID 62976900
(3S,4S)-1,3-dimethyl-4-(3-methylphenyl)piperidin-4-ol
CID 59263185
4-(1-benzofuran-2-yl)-1,3-dimethylpiperidin-4-ol
CID 23312254
2-[(4-methylpiperazin-1-yl)methyl]-1-thiophen-2-ylcyclohexan-1-ol
CID 10308365
2-propyl-1-thiophen-2-ylcyclopropan-1-ol
CID 79332590
1-methyl-4-thiophen-2-ylpiperidine-4-carbonitrile
CID 59443916
3-methyl-1-thiophen-2-ylcyclopentan-1-ol
CID 64513369
[(3R,4R)-4-hydroxy-1,3-dimethylpiperidin-4-yl]-phenylmethanone
CID 7377398
(3S)-3-methyl-1-[(1S,2R)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 10731255
(3R)-3-methyl-1-[(1S,2S)-2-methyl-1-thiophen-2-ylcyclohexyl]piperidine
CID 10660186
3-methyl-1-(2-methyl-1-thiophen-2-ylcyclohexyl)piperidine
CID 10707699
[(3S,4S)-1-benzyl-4-hydroxy-4-thiophen-2-ylpiperidin-3-yl]-thiophen-2-ylmethanone
CID 1278627

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol?
The IUPAC name of 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol (CID 130834241) is 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol.
What is the SMILES notation for 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol?
The canonical SMILES for 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol is CC1CN(C)CCC1(O)c1cccs1.
What is the InChIKey of 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol?
The InChIKey is FUZOZOGPFWJJIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-9-8-12(2)6-5-11(9,13)10-4-3-7-14-10/h3-4,7,9,13H,5-6,8H2,1-2H3.
What are the key properties of 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol?
1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol has a molecular weight of 211.33 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-thiophen-2-ylpiperidin-4-ol is sourced from PubChem (CID 130834241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).