[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone

C11H19NO3 — CID 115746294

IUPAC[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
SMILESO=C(C1CCOC1)N1CCC(CCO)C1
InChIInChI=1S/C11H19NO3/c13-5-2-9-1-4-12(7-9)11(14)10-3-6-15-8-10/h9-10,13H,1-8H2
InChIKeyLJNVZJFRVZAQKK-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.25
Rot. Bonds3

About [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone

[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone (PubChem CID 115746294) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
PubChem CID115746294
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
SMILESO=C(C1CCOC1)N1CCC(CCO)C1
InChIInChI=1S/C11H19NO3/c13-5-2-9-1-4-12(7-9)11(14)10-3-6-15-8-10/h9-10,13H,1-8H2
InChIKeyLJNVZJFRVZAQKK-UHFFFAOYSA-N
XLogP0.25
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(2-chloroethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 114801260
[3-(bromomethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 80666825
[4-(2-hydroxyethyl)piperidin-1-yl]-(oxan-4-yl)methanone
CID 121200652
[(3R)-3-(hydroxymethyl)pyrrolidin-1-yl]-(oxan-4-yl)methanone
CID 129367608
[(3S)-3-hydroxypyrrolidin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 129368564
[(3S)-3-hydroxypyrrolidin-1-yl]-[(3S)-oxolan-3-yl]methanone
CID 129368566
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(4-methylcyclohexyl)methanone
CID 115775330
[3-(aminomethyl)pyrrolidin-1-yl]-(oxan-3-yl)methanone
CID 62759965
(3R)-1-[(3R)-oxolane-3-carbonyl]pyrrolidine-3-carboxylic acid
CID 94917604
2-[3-(2-hydroxyethyl)pyrrolidine-1-carbonyl]cyclopentane-1-carboxylic acid
CID 114797273
[(3S)-3-(cyclopropylmethoxy)pyrrolidin-1-yl]-[(3S)-oxolan-3-yl]methanone
CID 129357459
[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 94191646

Frequently Asked Questions

What is the IUPAC name of [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone?
The IUPAC name of [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone (CID 115746294) is [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone.
What is the SMILES notation for [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone?
The canonical SMILES for [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone is O=C(C1CCOC1)N1CCC(CCO)C1.
What is the InChIKey of [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone?
The InChIKey is LJNVZJFRVZAQKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c13-5-2-9-1-4-12(7-9)11(14)10-3-6-15-8-10/h9-10,13H,1-8H2.
What are the key properties of [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone?
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone has a molecular weight of 213.28 g/mol, XLogP of 0.25, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone is sourced from PubChem (CID 115746294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).