2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine

C12H18N2O — CID 97162432

IUPAC2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine
SMILESC[C@@H](OC[C@@H]1CCCN1)c1ccccn1
InChIInChI=1S/C12H18N2O/c1-10(12-6-2-3-7-14-12)15-9-11-5-4-8-13-11/h2-3,6-7,10-11,13H,4-5,8-9H2,1H3/t10-,11+/m1/s1
InChIKeyNHLMXCJEOMBQLK-MNOVXSKESA-N
MW206.29 g/mol
LogP1.91
Rot. Bonds4

About 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine

2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine (PubChem CID 97162432) has the molecular formula C12H18N2O and a molecular weight of 206.29 g/mol. Its IUPAC name is 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine.

Molecular Properties

Compound Name2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine
PubChem CID97162432
Molecular FormulaC12H18N2O
Molecular Weight206.29 g/mol
Exact Mass206.14
IUPAC Name2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine
SMILESC[C@@H](OC[C@@H]1CCCN1)c1ccccn1
InChIInChI=1S/C12H18N2O/c1-10(12-6-2-3-7-14-12)15-9-11-5-4-8-13-11/h2-3,6-7,10-11,13H,4-5,8-9H2,1H3/t10-,11+/m1/s1
InChIKeyNHLMXCJEOMBQLK-MNOVXSKESA-N
XLogP1.91
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.29
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1R)-1-[[(2R)-pyrrolidin-2-yl]methoxy]ethyl]pyrazine
CID 97162438
2-(1-pyrrolidin-2-ylpropan-2-yl)pyridine
CID 83907313
2-[1-(cyclopropylmethoxy)ethyl]pyridine
CID 21278985
2-[(1S)-1-[[(2S)-piperidin-2-yl]methoxy]ethyl]pyrazine
CID 97162411
2-[1-(piperidin-2-ylmethoxy)ethyl]pyrazine;hydrochloride
CID 71637955
(2R)-2-[[(1S)-1-thiophen-2-ylethoxy]methyl]pyrrolidine
CID 97162429
1-piperidin-2-yl-N-[(1S)-1-pyridin-2-ylethyl]propan-2-amine
CID 81402179
(1S)-N-[[(2S)-piperidin-2-yl]methyl]-1-pyridin-2-ylethanesulfonamide
CID 97162061
1-piperidin-2-yl-N-[(1R)-1-pyridin-2-ylethyl]propan-2-amine
CID 81401502
N-(piperidin-2-ylmethyl)-N-(1-pyridin-2-ylethyl)propan-1-amine
CID 106623353
2-[(1S)-1-[[(2R)-piperidin-2-yl]methoxy]ethyl]-1,3-thiazole
CID 97162417
2-[(1S)-1-[[(2S)-piperidin-2-yl]methoxy]ethyl]-1,3-thiazole
CID 97162415

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine?
The IUPAC name of 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine (CID 97162432) is 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine.
What is the SMILES notation for 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine?
The canonical SMILES for 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine is C[C@@H](OC[C@@H]1CCCN1)c1ccccn1.
What is the InChIKey of 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine?
The InChIKey is NHLMXCJEOMBQLK-MNOVXSKESA-N. The full InChI is InChI=1S/C12H18N2O/c1-10(12-6-2-3-7-14-12)15-9-11-5-4-8-13-11/h2-3,6-7,10-11,13H,4-5,8-9H2,1H3/t10-,11+/m1/s1.
What are the key properties of 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine?
2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine has a molecular weight of 206.29 g/mol, XLogP of 1.91, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-1-[[(2S)-pyrrolidin-2-yl]methoxy]ethyl]pyridine is sourced from PubChem (CID 97162432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).