4-methyl-3-(thiophen-2-ylmethoxy)piperidine

C11H17NOS — CID 102954007

IUPAC4-methyl-3-(thiophen-2-ylmethoxy)piperidine
SMILESCC1CCNCC1OCc1cccs1
InChIInChI=1S/C11H17NOS/c1-9-4-5-12-7-11(9)13-8-10-3-2-6-14-10/h2-3,6,9,11-12H,4-5,7-8H2,1H3
InChIKeyHKHUOZPXJNMRES-UHFFFAOYSA-N
MW211.33 g/mol
LogP2.26
Rot. Bonds3

About 4-methyl-3-(thiophen-2-ylmethoxy)piperidine

4-methyl-3-(thiophen-2-ylmethoxy)piperidine (PubChem CID 102954007) has the molecular formula C11H17NOS and a molecular weight of 211.33 g/mol. Its IUPAC name is 4-methyl-3-(thiophen-2-ylmethoxy)piperidine.

Molecular Properties

Compound Name4-methyl-3-(thiophen-2-ylmethoxy)piperidine
PubChem CID102954007
Molecular FormulaC11H17NOS
Molecular Weight211.33 g/mol
Exact Mass211.10
IUPAC Name4-methyl-3-(thiophen-2-ylmethoxy)piperidine
SMILESCC1CCNCC1OCc1cccs1
InChIInChI=1S/C11H17NOS/c1-9-4-5-12-7-11(9)13-8-10-3-2-6-14-10/h2-3,6,9,11-12H,4-5,7-8H2,1H3
InChIKeyHKHUOZPXJNMRES-UHFFFAOYSA-N
XLogP2.26
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.33
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-3-phenylmethoxypiperidine
CID 102954119
4-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954056
N-(4-methylpiperidin-3-yl)-2-thiophen-2-ylethanesulfonamide
CID 120876347
3-(2-thiophen-2-ylethoxy)pyrrolidine
CID 62327416
2-[(4-methylpiperidin-3-yl)oxymethyl]benzamide
CID 102954062
4-methyl-3-[[4-(trifluoromethoxy)phenyl]methoxy]piperidine
CID 102954321
2-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]-1,3,4-oxadiazole
CID 102954373
4-methyl-3-(3-phenoxypropoxy)piperidine
CID 102954189
3-[(3-bromo-2,6-difluorophenyl)methoxy]-4-methylpiperidine
CID 106264583
3-methyl-5-[(4-methylpiperidin-3-yl)oxymethyl]pyridine
CID 102954306
4-methyl-3-[(2-methyl-3-nitrophenyl)methoxy]piperidine
CID 102954275
3-(2,3-dihydro-1-benzothiophen-2-ylmethoxy)-4-methylpiperidine
CID 102954247

Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-(thiophen-2-ylmethoxy)piperidine?
The IUPAC name of 4-methyl-3-(thiophen-2-ylmethoxy)piperidine (CID 102954007) is 4-methyl-3-(thiophen-2-ylmethoxy)piperidine.
What is the SMILES notation for 4-methyl-3-(thiophen-2-ylmethoxy)piperidine?
The canonical SMILES for 4-methyl-3-(thiophen-2-ylmethoxy)piperidine is CC1CCNCC1OCc1cccs1.
What is the InChIKey of 4-methyl-3-(thiophen-2-ylmethoxy)piperidine?
The InChIKey is HKHUOZPXJNMRES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NOS/c1-9-4-5-12-7-11(9)13-8-10-3-2-6-14-10/h2-3,6,9,11-12H,4-5,7-8H2,1H3.
What are the key properties of 4-methyl-3-(thiophen-2-ylmethoxy)piperidine?
4-methyl-3-(thiophen-2-ylmethoxy)piperidine has a molecular weight of 211.33 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-(thiophen-2-ylmethoxy)piperidine is sourced from PubChem (CID 102954007), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).