3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine

C15H18N2OS — CID 15480240

IUPAC3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine
SMILESCN1CCC[C@H]1COc1cncc(-c2cccs2)c1
InChIInChI=1S/C15H18N2OS/c1-17-6-2-4-13(17)11-18-14-8-12(9-16-10-14)15-5-3-7-19-15/h3,5,7-10,13H,2,4,6,11H2,1H3/t13-/m0/s1
InChIKeyBDLRRKNPBZCCST-ZDUSSCGKSA-N
MW274.39 g/mol
LogP3.28
Rot. Bonds4

About 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine

3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine (PubChem CID 15480240) has the molecular formula C15H18N2OS and a molecular weight of 274.39 g/mol. Its IUPAC name is 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine.

Molecular Properties

Compound Name3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine
PubChem CID15480240
Molecular FormulaC15H18N2OS
Molecular Weight274.39 g/mol
Exact Mass274.11
IUPAC Name3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine
SMILESCN1CCC[C@H]1COc1cncc(-c2cccs2)c1
InChIInChI=1S/C15H18N2OS/c1-17-6-2-4-13(17)11-18-14-8-12(9-16-10-14)15-5-3-7-19-15/h3,5,7-10,13H,2,4,6,11H2,1H3/t13-/m0/s1
InChIKeyBDLRRKNPBZCCST-ZDUSSCGKSA-N
XLogP3.28
TPSA25.36 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.39
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-phenyl-pyridine
CID 9840916
3-Butyl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 10083372
3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-(2-pyridin-4-yl-ethyl)-pyridine
CID 10469925
5-(3-Pyridyl)-3-(1-methyl-2-(s)-pyrrolidinylmethoxy)pyridine
CID 15480241
3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-((E)-styryl)-pyridine
CID 22872637
3-Hexyl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 44318727
3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-propyl-pyridine
CID 44318740
3-Ethyl-5-((S)-1-methyl-pyrrolidin-2-ylmethoxy)-pyridine
CID 44318995
3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-phenethyl-pyridine
CID 44371959
3-((S)-1-Methyl-pyrrolidin-2-ylmethoxy)-5-p-tolyl-pyridine
CID 44372094
3-[(1-Methylpyrrolidin-2-yl)methoxy]-5-(2-phenylethyl)pyridine
CID 18458840
2-Methoxy-5-(3-methyl-thiophen-2-yl)-pyridine
CID 11206520

Frequently Asked Questions

What is the IUPAC name of 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine?
The IUPAC name of 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine (CID 15480240) is 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine.
What is the SMILES notation for 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine?
The canonical SMILES for 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine is CN1CCC[C@H]1COc1cncc(-c2cccs2)c1.
What is the InChIKey of 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine?
The InChIKey is BDLRRKNPBZCCST-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H18N2OS/c1-17-6-2-4-13(17)11-18-14-8-12(9-16-10-14)15-5-3-7-19-15/h3,5,7-10,13H,2,4,6,11H2,1H3/t13-/m0/s1.
What are the key properties of 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine?
3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine has a molecular weight of 274.39 g/mol, XLogP of 3.28, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(2S)-1-methylpyrrolidin-2-yl]methoxy]-5-thiophen-2-ylpyridine is sourced from PubChem (CID 15480240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).