1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone

C13H25N3O3 — CID 43091152

IUPAC1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
SMILESO=C(CNCCCN1CCOCC1)N1CCOCC1
InChIInChI=1S/C13H25N3O3/c17-13(16-6-10-19-11-7-16)12-14-2-1-3-15-4-8-18-9-5-15/h14H,1-12H2
InChIKeySCALQIZIARHLKJ-UHFFFAOYSA-N
MW271.36 g/mol
LogP-0.84
Rot. Bonds6

About 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone

1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone (PubChem CID 43091152) has the molecular formula C13H25N3O3 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone.

Molecular Properties

Compound Name1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
PubChem CID43091152
Molecular FormulaC13H25N3O3
Molecular Weight271.36 g/mol
Exact Mass271.19
IUPAC Name1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone
SMILESO=C(CNCCCN1CCOCC1)N1CCOCC1
InChIInChI=1S/C13H25N3O3/c17-13(16-6-10-19-11-7-16)12-14-2-1-3-15-4-8-18-9-5-15/h14H,1-12H2
InChIKeySCALQIZIARHLKJ-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'}

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Related Compounds

2-(4-methoxybutylamino)-1-morpholin-4-ylethanone
CID 60975832
N,N'-bis(3-morpholin-4-ylpropyl)propanediamide
CID 21205309
2-(3-ethoxypropylamino)-1-morpholin-4-ylethanone
CID 28584674
ethyl 4-[2-(2-morpholin-4-ylethylamino)acetyl]piperazine-1-carboxylate
CID 108994784
1-morpholin-4-yl-3-(2-morpholin-4-ylethylamino)propan-1-one
CID 109015660
2-[3-(2-methoxyethoxy)propylamino]-1-morpholin-4-ylethanone
CID 113219536
N-[2-[(2-morpholin-4-yl-2-oxoethyl)amino]ethyl]acetamide
CID 43400877
2-(2-morpholin-4-ylethylamino)acetic acid
CID 28897547
2-methyl-1-(3-morpholin-4-ylpropylamino)propan-2-ol
CID 60886953
3-morpholin-4-yl-N-(2-morpholin-4-ylethyl)-3-oxopropanamide
CID 108943424
5-(3-morpholin-4-ylpropylamino)pentan-1-ol
CID 62227528
N-butyl-2-[(2-morpholin-4-yl-2-oxoethyl)amino]acetamide
CID 113406059

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone?
The IUPAC name of 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone (CID 43091152) is 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone.
What is the SMILES notation for 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone?
The canonical SMILES for 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone is O=C(CNCCCN1CCOCC1)N1CCOCC1.
What is the InChIKey of 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone?
The InChIKey is SCALQIZIARHLKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N3O3/c17-13(16-6-10-19-11-7-16)12-14-2-1-3-15-4-8-18-9-5-15/h14H,1-12H2.
What are the key properties of 1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone?
1-morpholin-4-yl-2-(3-morpholin-4-ylpropylamino)ethanone 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-2-(3-morpholin-4-ylpropylamino)ethanone is sourced from PubChem (CID 43091152), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).