2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one

C8H16N2O3 — CID 81082196

IUPAC2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one
SMILESCOCC(N)C(=O)N1CCOCC1
InChIInChI=1S/C8H16N2O3/c1-12-6-7(9)8(11)10-2-4-13-5-3-10/h7H,2-6,9H2,1H3
InChIKeyDHDWTLAAMGLTNN-UHFFFAOYSA-N
MW188.23 g/mol
LogP-1.18
Rot. Bonds3

About 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one

2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one (PubChem CID 81082196) has the molecular formula C8H16N2O3 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one.

Molecular Properties

Compound Name2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one
PubChem CID81082196
Molecular FormulaC8H16N2O3
Molecular Weight188.23 g/mol
Exact Mass188.12
IUPAC Name2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one
SMILESCOCC(N)C(=O)N1CCOCC1
InChIInChI=1S/C8H16N2O3/c1-12-6-7(9)8(11)10-2-4-13-5-3-10/h7H,2-6,9H2,1H3
InChIKeyDHDWTLAAMGLTNN-UHFFFAOYSA-N
XLogP-1.18
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 5-1.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,4-Diamino-1-morpholin-4-yl-butan-1-one
CID 44364253
2-Amino-1-(morpholin-4-yl)butan-1-one
CID 22273198
N-[3-(morpholin-4-yl)propyl]-N'-(propan-2-yl)ethanediamide
CID 2055735
2-Amino-1-(morpholin-4-yl)propan-1-one hydrochloride
CID 22722814
(2S)-2-amino-1-(morpholin-4-yl)butan-1-one hydrochloride
CID 86690681
(2R)-2-amino-1-morpholin-4-ylpropan-1-one;hydrochloride
CID 156637014
N-(2-methoxyethyl)-2-(4-methylpiperazin-1-yl)propanamide
CID 3229463
N-butan-2-yl-2-morpholin-4-ylacetamide
CID 17634927
2-[4-(2-methoxyacetyl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 53513028
2-(2-ethylmorpholin-4-yl)-N-propan-2-ylacetamide
CID 53525512
N-[2-[3-ethyl-4-(2-methoxyethyl)piperazin-1-yl]ethyl]acetamide
CID 53624131
N,N-dimethylmorpholine-3-carboxamide hydrochloride
CID 137698815

Frequently Asked Questions

What is the IUPAC name of 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one?
The IUPAC name of 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one (CID 81082196) is 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one.
What is the SMILES notation for 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one?
The canonical SMILES for 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one is COCC(N)C(=O)N1CCOCC1.
What is the InChIKey of 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one?
The InChIKey is DHDWTLAAMGLTNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O3/c1-12-6-7(9)8(11)10-2-4-13-5-3-10/h7H,2-6,9H2,1H3.
What are the key properties of 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one?
2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one has a molecular weight of 188.23 g/mol, XLogP of -1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-3-methoxy-1-morpholin-4-ylpropan-1-one is sourced from PubChem (CID 81082196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).