2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol

C16H22N4O — CID 95815943

IUPAC2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol
SMILESCCc1nccn1-c1cccc([C@H]2CCCN2CCO)n1
InChIInChI=1S/C16H22N4O/c1-2-15-17-8-10-20(15)16-7-3-5-13(18-16)14-6-4-9-19(14)11-12-21/h3,5,7-8,10,14,21H,2,4,6,9,11-12H2,1H3/t14-/m1/s1
InChIKeyJZGYFRDFGQTCKH-CQSZACIVSA-N
MW286.38 g/mol
LogP1.96
Rot. Bonds5

About 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol

2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol (PubChem CID 95815943) has the molecular formula C16H22N4O and a molecular weight of 286.38 g/mol. Its IUPAC name is 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol.

Molecular Properties

Compound Name2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol
PubChem CID95815943
Molecular FormulaC16H22N4O
Molecular Weight286.38 g/mol
Exact Mass286.18
IUPAC Name2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol
SMILESCCc1nccn1-c1cccc([C@H]2CCCN2CCO)n1
InChIInChI=1S/C16H22N4O/c1-2-15-17-8-10-20(15)16-7-3-5-13(18-16)14-6-4-9-19(14)11-12-21/h3,5,7-8,10,14,21H,2,4,6,9,11-12H2,1H3/t14-/m1/s1
InChIKeyJZGYFRDFGQTCKH-CQSZACIVSA-N
XLogP1.96
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-ethylimidazol-1-yl)-6-[(2S)-1-methylpyrrolidin-2-yl]pyridine
CID 95839014
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-(3-phenylpropyl)pyrrolidin-2-yl]pyridine
CID 95839027
2-(1-benzylpyrrolidin-2-yl)-6-(2-ethylimidazol-1-yl)pyridine
CID 110268024
1-[(2S)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95815928
2-(2-ethylimidazol-1-yl)-6-[(2R)-1-(thiophen-3-ylmethyl)pyrrolidin-2-yl]pyridine
CID 95815941
[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone
CID 95839151
1-[2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]-2-pyrrolidin-1-ylethanone
CID 110268084
[(2S)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]-(4-fluorophenyl)methanone
CID 95838768
2-(2-ethylimidazol-1-yl)-6-[(3R)-1-methylpiperidin-3-yl]pyridine
CID 95839018
2-(dimethylamino)-1-[(2S)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanone
CID 95838931
1-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]-2-phenoxyethanone
CID 95838940
2-[(3R)-3-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]piperidin-1-yl]acetamide
CID 95815984

Frequently Asked Questions

What is the IUPAC name of 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol?
The IUPAC name of 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol (CID 95815943) is 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol.
What is the SMILES notation for 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol?
The canonical SMILES for 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol is CCc1nccn1-c1cccc([C@H]2CCCN2CCO)n1.
What is the InChIKey of 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol?
The InChIKey is JZGYFRDFGQTCKH-CQSZACIVSA-N. The full InChI is InChI=1S/C16H22N4O/c1-2-15-17-8-10-20(15)16-7-3-5-13(18-16)14-6-4-9-19(14)11-12-21/h3,5,7-8,10,14,21H,2,4,6,9,11-12H2,1H3/t14-/m1/s1.
What are the key properties of 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol?
2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol has a molecular weight of 286.38 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2R)-2-[6-(2-ethylimidazol-1-yl)-2-pyridinyl]pyrrolidin-1-yl]ethanol is sourced from PubChem (CID 95815943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).