1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one

C13H25N3O3 — CID 109015660

IUPAC1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one
SMILESO=C(CCNCCN1CCOCC1)N1CCOCC1
InChIInChI=1S/C13H25N3O3/c17-13(16-7-11-19-12-8-16)1-2-14-3-4-15-5-9-18-10-6-15/h14H,1-12H2
InChIKeyATSBKAJGNUCQJI-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.84
Rot. Bonds6

About 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one

1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one (PubChem CID 109015660) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one.

Molecular Properties

Compound Name1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one
PubChem CID109015660
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one
SMILESO=C(CCNCCN1CCOCC1)N1CCOCC1
InChIInChI=1S/C13H25N3O3/c17-13(16-7-11-19-12-8-16)1-2-14-3-4-15-5-9-18-10-6-15/h14H,1-12H2
InChIKeyATSBKAJGNUCQJI-UHFFFAOYSA-N
XLogP-0.84
TPSA54.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 5-0.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one 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

1-(4-acetylpiperazin-1-yl)-3-(2-morpholin-4-ylethylamino)propan-1-one
CID 109016693
3-(2-morpholin-4-ylethylamino)propanoic acid
CID 28830354
3-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
CID 108943424
1-[4-(2-methoxyphenyl)piperazin-1-yl]-3-(2-morpholin-4-ylethylamino)propan-1-one
CID 109016734
5-(2-morpholin-4-ylethylamino)pentanoic acid
CID 103235757
1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
CID 43091152
1-morpholin-4-yl-3-(prop-2-enylamino)propan-1-one
CID 109011993
3-[2-[(2-methylpropan-2-yl)oxy]ethylamino]-1-morpholin-4-ylpropan-1-one
CID 113411382
1-morpholin-4-yl-3-[2-(trifluoromethylsulfanyl)ethylamino]propan-1-one
CID 116615757
2-(2-morpholin-4-ylethylamino)acetic acid
CID 28897547
N-methyl-4-(2-morpholin-4-ylethylamino)butanamide
CID 63892681
3-[(3-hydroxy-2,2-dimethylpropyl)amino]-1-morpholin-4-ylpropan-1-one
CID 113411282

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one?
The IUPAC name of 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one (CID 109015660) is 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one.
What is the SMILES notation for 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one?
The canonical SMILES for 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one is O=C(CCNCCN1CCOCC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one?
The InChIKey is ATSBKAJGNUCQJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c17-13(16-7-11-19-12-8-16)1-2-14-3-4-15-5-9-18-10-6-15/h14H,1-12H2.
What are the key properties of 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one?
1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one has a molecular weight of 271.36 g/mol, XLogP of -0.84, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one is sourced from PubChem (CID 109015660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).