[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone

C11H20N2O3 — CID 107217226

IUPAC[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CC[C@@H](O)C1
InChIInChI=1S/C11H20N2O3/c1-2-12-10-7-16-6-9(10)11(15)13-4-3-8(14)5-13/h8-10,12,14H,2-7H2,1H3/t8-,9?,10?/m1/s1
InChIKeyRPDBJJBIXYRBPE-XNWIYYODSA-N
MW228.29 g/mol
LogP-0.80
Rot. Bonds3

About [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone

[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (PubChem CID 107217226) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
PubChem CID107217226
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
SMILESCCNC1COCC1C(=O)N1CC[C@@H](O)C1
InChIInChI=1S/C11H20N2O3/c1-2-12-10-7-16-6-9(10)11(15)13-4-3-8(14)5-13/h8-10,12,14H,2-7H2,1H3/t8-,9?,10?/m1/s1
InChIKeyRPDBJJBIXYRBPE-XNWIYYODSA-N
XLogP-0.80
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The IUPAC name of [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone (CID 107217226) is [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone.
What is the SMILES notation for [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The canonical SMILES for [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is CCNC1COCC1C(=O)N1CC[C@@H](O)C1.
What is the InChIKey of [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
The InChIKey is RPDBJJBIXYRBPE-XNWIYYODSA-N. The full InChI is InChI=1S/C11H20N2O3/c1-2-12-10-7-16-6-9(10)11(15)13-4-3-8(14)5-13/h8-10,12,14H,2-7H2,1H3/t8-,9?,10?/m1/s1.
What are the key properties of [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone?
[4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone has a molecular weight of 228.29 g/mol, XLogP of -0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)oxolan-3-yl]-[(3R)-3-hydroxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 107217226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).