[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone

C11H20N2O3 — CID 94191646

IUPAC[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
SMILESO=C([C@@H]1CCOC1)N1CCN(CCO)CC1
InChIInChI=1S/C11H20N2O3/c14-7-6-12-2-4-13(5-3-12)11(15)10-1-8-16-9-10/h10,14H,1-9H2/t10-/m1/s1
InChIKeyMHWPKSWQNFJCOJ-SNVBAGLBSA-N
MW228.29 g/mol
LogP-0.84
Rot. Bonds3

About [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone

[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone (PubChem CID 94191646) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone.

Molecular Properties

Compound Name[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
PubChem CID94191646
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
SMILESO=C([C@@H]1CCOC1)N1CCN(CCO)CC1
InChIInChI=1S/C11H20N2O3/c14-7-6-12-2-4-13(5-3-12)11(15)10-1-8-16-9-10/h10,14H,1-9H2/t10-/m1/s1
InChIKeyMHWPKSWQNFJCOJ-SNVBAGLBSA-N
XLogP-0.84
TPSA53.01 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]-(oxolan-3-yl)methanone
CID 55204831
[4-[6-[4-(2-hydroxyethyl)piperazin-1-yl]pyridazin-3-yl]piperazin-1-yl]-(oxolan-3-yl)methanone
CID 122336726
2-[4-(oxolane-3-carbonyl)piperazin-1-yl]-1-piperidin-1-ylethanone
CID 86850684
1,4-dioxan-2-yl-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 43427982
[4-[(2S)-2-hydroxybutyl]piperazin-1-yl]-[(3S)-oxolan-3-yl]methanone
CID 95342573
cyclopropyl-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]methanone
CID 63308401
[4-[(2R)-2-hydroxy-3,3-dimethylbutyl]piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 95325634
cyclobutyl-[4-[2-(oxolan-3-yl)ethyl]piperazin-1-yl]methanone
CID 131899076
cycloheptyl-[4-(2-hydroxyethyl)-1,4-diazepan-1-yl]methanone
CID 63309624
[3-(2-hydroxyethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone
CID 115746294
N,N-dimethyl-2-[4-(oxolane-3-carbonyl)-1,4-diazepan-1-yl]acetamide
CID 131905064
[4-(1-hydroxyethyl)piperidin-1-yl]-(oxolan-3-yl)methanone
CID 112537686

Frequently Asked Questions

What is the IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone?
The IUPAC name of [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone (CID 94191646) is [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone.
What is the SMILES notation for [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone?
The canonical SMILES for [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone is O=C([C@@H]1CCOC1)N1CCN(CCO)CC1.
What is the InChIKey of [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone?
The InChIKey is MHWPKSWQNFJCOJ-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-7-6-12-2-4-13(5-3-12)11(15)10-1-8-16-9-10/h10,14H,1-9H2/t10-/m1/s1.
What are the key properties of [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone?
[4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone has a molecular weight of 228.29 g/mol, XLogP of -0.84, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-hydroxyethyl)piperazin-1-yl]-[(3R)-oxolan-3-yl]methanone is sourced from PubChem (CID 94191646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).