6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide

C15H26N2O5 — CID 59567294

IUPAC6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide
SMILESCOCC(=O)CCCC(=O)NCCC(=O)NCCCC(C)=O
InChIInChI=1S/C15H26N2O5/c1-12(18)5-4-9-16-15(21)8-10-17-14(20)7-3-6-13(19)11-22-2/h3-11H2,1-2H3,(H,16,21)(H,17,20)
InChIKeyKIFQWGVAWUPUDY-UHFFFAOYSA-N
MW314.38 g/mol
LogP0.36
Rot. Bonds13

About 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide

6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide (PubChem CID 59567294) has the molecular formula C15H26N2O5 and a molecular weight of 314.38 g/mol. Its IUPAC name is 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide.

Molecular Properties

Compound Name6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide
PubChem CID59567294
Molecular FormulaC15H26N2O5
Molecular Weight314.38 g/mol
Exact Mass314.18
IUPAC Name6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide
SMILESCOCC(=O)CCCC(=O)NCCC(=O)NCCCC(C)=O
InChIInChI=1S/C15H26N2O5/c1-12(18)5-4-9-16-15(21)8-10-17-14(20)7-3-6-13(19)11-22-2/h3-11H2,1-2H3,(H,16,21)(H,17,20)
InChIKeyKIFQWGVAWUPUDY-UHFFFAOYSA-N
XLogP0.36
TPSA101.57 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.38
LogP ≤ 50.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

6-methoxy-5-oxo-N-(5-oxohexyl)hexanamide
CID 59567253
6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide
CID 59567342
N-(6,10-dioxoundecyl)-2-methoxyacetamide
CID 167591874
8,13-dioxo-13-(6-oxoheptylamino)tridecanoic acid
CID 159429348
methanethiol;molecular hydrogen;5-oxo-N-propylhexanamide
CID 178099887
4-chloro-N-[2-[(2-methoxyacetyl)amino]ethyl]butanamide
CID 108574582
N-butyl-12-oxotridecanamide
CID 158110868
N-butyl-7-oxooctanamide
CID 153419892
ethane;4-(methylamino)-N-(6-oxoheptyl)butanamide
CID 177339122
5-oxo-N-[3-[2-[2-[3-(pentanoylamino)propoxy]ethoxy]ethoxy]propyl]hexanamide
CID 129222312
methyl 3-[(2-methoxyacetyl)amino]propanoate
CID 60637209
6-oxo-N-[2-[2-(6-oxoheptanoylamino)ethylamino]ethyl]heptanamide
CID 20656550

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide?
The IUPAC name of 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide (CID 59567294) is 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide.
What is the SMILES notation for 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide?
The canonical SMILES for 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide is COCC(=O)CCCC(=O)NCCC(=O)NCCCC(C)=O.
What is the InChIKey of 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide?
The InChIKey is KIFQWGVAWUPUDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O5/c1-12(18)5-4-9-16-15(21)8-10-17-14(20)7-3-6-13(19)11-22-2/h3-11H2,1-2H3,(H,16,21)(H,17,20).
What are the key properties of 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide?
6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide has a molecular weight of 314.38 g/mol, XLogP of 0.36, 13 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide is sourced from PubChem (CID 59567294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).