3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one

C10H18N2O3 — CID 115315441

IUPAC3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one
SMILESCC(N)C1CN(C2CCOC2=O)CCO1
InChIInChI=1S/C10H18N2O3/c1-7(11)9-6-12(3-5-14-9)8-2-4-15-10(8)13/h7-9H,2-6,11H2,1H3
InChIKeyYEFYCKGKUAKVRX-UHFFFAOYSA-N
MW214.26 g/mol
LogP-0.65
Rot. Bonds2

About 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one

3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one (PubChem CID 115315441) has the molecular formula C10H18N2O3 and a molecular weight of 214.26 g/mol. Its IUPAC name is 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one.

Molecular Properties

Compound Name3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one
PubChem CID115315441
Molecular FormulaC10H18N2O3
Molecular Weight214.26 g/mol
Exact Mass214.13
IUPAC Name3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one
SMILESCC(N)C1CN(C2CCOC2=O)CCO1
InChIInChI=1S/C10H18N2O3/c1-7(11)9-6-12(3-5-14-9)8-2-4-15-10(8)13/h7-9H,2-6,11H2,1H3
InChIKeyYEFYCKGKUAKVRX-UHFFFAOYSA-N
XLogP-0.65
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.26
LogP ≤ 5-0.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one?
The IUPAC name of 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one (CID 115315441) is 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one.
What is the SMILES notation for 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one?
The canonical SMILES for 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one is CC(N)C1CN(C2CCOC2=O)CCO1.
What is the InChIKey of 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one?
The InChIKey is YEFYCKGKUAKVRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O3/c1-7(11)9-6-12(3-5-14-9)8-2-4-15-10(8)13/h7-9H,2-6,11H2,1H3.
What are the key properties of 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one?
3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one has a molecular weight of 214.26 g/mol, XLogP of -0.65, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(1-aminoethyl)morpholin-4-yl]oxolan-2-one is sourced from PubChem (CID 115315441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).