(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol

C13H20N2O — CID 83132296

IUPAC(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol
SMILESCCC1CCCN1c1ccc([C@H](C)O)nc1
InChIInChI=1S/C13H20N2O/c1-3-11-5-4-8-15(11)12-6-7-13(10(2)16)14-9-12/h6-7,9-11,16H,3-5,8H2,1-2H3/t10-,11?/m0/s1
InChIKeySRTZJDHBAOMAEI-VUWPPUDQSA-N
MW220.32 g/mol
LogP2.51
Rot. Bonds3

About (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol

(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol (PubChem CID 83132296) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol.

Molecular Properties

Compound Name(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol
PubChem CID83132296
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC Name(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol
SMILESCCC1CCCN1c1ccc([C@H](C)O)nc1
InChIInChI=1S/C13H20N2O/c1-3-11-5-4-8-15(11)12-6-7-13(10(2)16)14-9-12/h6-7,9-11,16H,3-5,8H2,1-2H3/t10-,11?/m0/s1
InChIKeySRTZJDHBAOMAEI-VUWPPUDQSA-N
XLogP2.51
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(1R)-1-[5-(2-propan-2-ylpyrrolidin-1-yl)-2-pyridinyl]ethanol
CID 83131400
1-[5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-pyridinyl]ethanol
CID 83132541
(1R)-1-[5-(2-cyclopentylpyrrolidin-1-yl)-2-pyridinyl]ethanol
CID 83132239
(1R)-1-[5-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-2-pyridinyl]ethanol
CID 83132593
5-(2-ethylpyrrolidin-1-yl)pyridin-2-amine
CID 60973489
1-[6-[(1R)-1-hydroxyethyl]-3-pyridinyl]pyrrolidine-2-carboxamide
CID 83131762
1-[6-(1-hydroxyethyl)-3-pyridinyl]pyrrolidine-2-carboxamide
CID 83131679
[1-[6-[1-(ethylamino)ethyl]-3-pyridinyl]pyrrolidin-2-yl]methanol
CID 83122489
[1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]piperidin-2-yl]methanol
CID 83122235
3-[1-[6-[(1R)-1-aminoethyl]-3-pyridinyl]pyrrolidin-2-yl]propan-1-ol
CID 83122786
5-(2-ethylazepan-1-yl)pyridine-2-carboxylic acid
CID 104690117
1-[5-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-2-pyridinyl]propan-1-ol
CID 115940385

Frequently Asked Questions

What is the IUPAC name of (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The IUPAC name of (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol (CID 83132296) is (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol.
What is the SMILES notation for (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The canonical SMILES for (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol is CCC1CCCN1c1ccc([C@H](C)O)nc1.
What is the InChIKey of (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
The InChIKey is SRTZJDHBAOMAEI-VUWPPUDQSA-N. The full InChI is InChI=1S/C13H20N2O/c1-3-11-5-4-8-15(11)12-6-7-13(10(2)16)14-9-12/h6-7,9-11,16H,3-5,8H2,1-2H3/t10-,11?/m0/s1.
What are the key properties of (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol?
(1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol has a molecular weight of 220.32 g/mol, XLogP of 2.51, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-1-[5-(2-ethylpyrrolidin-1-yl)-2-pyridinyl]ethanol is sourced from PubChem (CID 83132296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).