1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone

C11H20N2O3 — CID 65152128

IUPAC1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone
SMILESNCC1CN(C(=O)CC2CCCO2)CCO1
InChIInChI=1S/C11H20N2O3/c12-7-10-8-13(3-5-16-10)11(14)6-9-2-1-4-15-9/h9-10H,1-8,12H2
InChIKeyOFFHJMVWDLJXLL-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.26
Rot. Bonds3

About 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone

1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone (PubChem CID 65152128) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone.

Molecular Properties

Compound Name1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone
PubChem CID65152128
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone
SMILESNCC1CN(C(=O)CC2CCCO2)CCO1
InChIInChI=1S/C11H20N2O3/c12-7-10-8-13(3-5-16-10)11(14)6-9-2-1-4-15-9/h9-10H,1-8,12H2
InChIKeyOFFHJMVWDLJXLL-UHFFFAOYSA-N
XLogP-0.26
TPSA64.79 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 ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[2-(aminomethyl)morpholin-4-yl]-2-cyclobutylethanone
CID 104922136
2-[(2S)-4-[2-[(2R)-oxolan-2-yl]acetyl]morpholin-2-yl]acetic acid
CID 124515284
(2R)-4-[2-[(2S)-oxolan-2-yl]acetyl]morpholine-2-carboxylic acid
CID 124512416
1-(3-aminopiperidin-1-yl)-2-(oxolan-2-yl)ethanone
CID 65160580
1-(3-bromopiperidin-1-yl)-2-(oxolan-2-yl)ethanone
CID 80660576
2-[(2S)-4-[3-[(2S)-oxolan-2-yl]propanoyl]morpholin-2-yl]acetic acid
CID 124515387
1-[2-(oxolan-2-yl)acetyl]piperidine-3-sulfonamide
CID 64867820
1-[3-(methylaminomethyl)pyrrolidin-1-yl]-2-(oxolan-2-yl)ethanone
CID 65160440
1-[2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-2-(oxan-2-yl)ethanone
CID 128992624
1-[(2R)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-2-[(2S)-oxan-2-yl]ethanone
CID 129343530
1-[(2R)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-2-[(2R)-oxan-2-yl]ethanone
CID 129343529
1-[(2S)-2-[[cyclopropylmethyl(methyl)amino]methyl]morpholin-4-yl]-2-[(2S)-oxan-2-yl]ethanone
CID 129343528

Frequently Asked Questions

What is the IUPAC name of 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone?
The IUPAC name of 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone (CID 65152128) is 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone.
What is the SMILES notation for 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone?
The canonical SMILES for 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone is NCC1CN(C(=O)CC2CCCO2)CCO1.
What is the InChIKey of 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone?
The InChIKey is OFFHJMVWDLJXLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c12-7-10-8-13(3-5-16-10)11(14)6-9-2-1-4-15-9/h9-10H,1-8,12H2.
What are the key properties of 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone?
1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone has a molecular weight of 228.29 g/mol, XLogP of -0.26, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(aminomethyl)morpholin-4-yl]-2-(oxolan-2-yl)ethanone is sourced from PubChem (CID 65152128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).