[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone

C12H21NO4 — CID 103899128

IUPAC[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
SMILESO=C([C@H]1CCCO1)N1CCC(OCCO)CC1
InChIInChI=1S/C12H21NO4/c14-7-9-16-10-3-5-13(6-4-10)12(15)11-2-1-8-17-11/h10-11,14H,1-9H2/t11-/m1/s1
InChIKeyDAFZJVQKADRJNQ-LLVKDONJSA-N
MW243.30 g/mol
LogP0.17
Rot. Bonds4

About [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone

[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone (PubChem CID 103899128) has the molecular formula C12H21NO4 and a molecular weight of 243.30 g/mol. Its IUPAC name is [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone.

Molecular Properties

Compound Name[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
PubChem CID103899128
Molecular FormulaC12H21NO4
Molecular Weight243.30 g/mol
Exact Mass243.15
IUPAC Name[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone
SMILESO=C([C@H]1CCCO1)N1CCC(OCCO)CC1
InChIInChI=1S/C12H21NO4/c14-7-9-16-10-3-5-13(6-4-10)12(15)11-2-1-8-17-11/h10-11,14H,1-9H2/t11-/m1/s1
InChIKeyDAFZJVQKADRJNQ-LLVKDONJSA-N
XLogP0.17
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.30
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-[1-[(2S)-oxolane-2-carbonyl]piperidin-4-yl]oxypropanoic acid
CID 104855710
2-[1-(oxane-2-carbonyl)piperidin-4-yl]oxyacetic acid
CID 55250892
N-(3-cyclopentyloxypropyl)-1-[(2S)-oxolane-2-carbonyl]piperidine-4-carboxamide
CID 125438596
2-methoxy-1-[4-[(2S)-oxolane-2-carbonyl]piperazin-1-yl]ethanone
CID 94150662
[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-(oxolan-2-yl)methanone
CID 63308795
[(2R)-oxolan-2-yl]-[4-[4-(pyrrolidin-1-ylmethyl)phenoxy]piperidin-1-yl]methanone
CID 42190251
[4-(2-hydroxyethoxy)piperidin-1-yl]-(thian-2-yl)methanone
CID 82691873
(4-methanidylpiperazin-1-yl)-(oxolan-2-yl)methanone
CID 59620099
ethane;1-[4-(oxolane-2-carbonyl)piperazin-1-yl]ethanone
CID 143678083
azepan-1-yl(oxan-2-yl)methanone
CID 64592467
[2-(aminomethyl)cyclopentyl]-[4-(2-hydroxyethoxy)piperidin-1-yl]methanone
CID 82695746
[(3R)-3-methylpyrrolidin-1-yl]-[(2R)-oxolan-2-yl]methanone
CID 143794584

Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone?
The IUPAC name of [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone (CID 103899128) is [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone.
What is the SMILES notation for [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone?
The canonical SMILES for [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone is O=C([C@H]1CCCO1)N1CCC(OCCO)CC1.
What is the InChIKey of [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone?
The InChIKey is DAFZJVQKADRJNQ-LLVKDONJSA-N. The full InChI is InChI=1S/C12H21NO4/c14-7-9-16-10-3-5-13(6-4-10)12(15)11-2-1-8-17-11/h10-11,14H,1-9H2/t11-/m1/s1.
What are the key properties of [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone?
[4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone has a molecular weight of 243.30 g/mol, XLogP of 0.17, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethoxy)piperidin-1-yl]-[(2R)-oxolan-2-yl]methanone is sourced from PubChem (CID 103899128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).