6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide

C11H19NO4 — CID 59567342

IUPAC6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide
SMILESCOCC(=O)CCCC(=O)NCCC(C)=O
InChIInChI=1S/C11H19NO4/c1-9(13)6-7-12-11(15)5-3-4-10(14)8-16-2/h3-8H2,1-2H3,(H,12,15)
InChIKeyDJEUBCXYKBDSBR-UHFFFAOYSA-N
MW229.28 g/mol
LogP0.47
Rot. Bonds9

About 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide

6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide (PubChem CID 59567342) has the molecular formula C11H19NO4 and a molecular weight of 229.28 g/mol. Its IUPAC name is 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide.

Molecular Properties

Compound Name6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide
PubChem CID59567342
Molecular FormulaC11H19NO4
Molecular Weight229.28 g/mol
Exact Mass229.13
IUPAC Name6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide
SMILESCOCC(=O)CCCC(=O)NCCC(C)=O
InChIInChI=1S/C11H19NO4/c1-9(13)6-7-12-11(15)5-3-4-10(14)8-16-2/h3-8H2,1-2H3,(H,12,15)
InChIKeyDJEUBCXYKBDSBR-UHFFFAOYSA-N
XLogP0.47
TPSA72.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-methoxy-5-oxo-N-[3-oxo-3-(4-oxopentylamino)propyl]hexanamide
CID 59567294
6-methoxy-5-oxo-N-(5-oxohexyl)hexanamide
CID 59567253
N-(6,10-dioxoundecyl)-2-methoxyacetamide
CID 167591874
4-chloro-N-[2-[(2-methoxyacetyl)amino]ethyl]butanamide
CID 108574582
methyl 3-[(2-methoxyacetyl)amino]propanoate
CID 60637209
2-methoxy-N-[2-[2-[2-[2-(3-oxobutoxy)ethoxy]ethoxy]ethoxy]ethyl]acetamide
CID 118668919
6-methoxy-5-oxohexanoic acid
CID 46897878
2-bromo-N-(3-oxobutyl)acetamide
CID 58311881
3-oxo-N-(3-oxobutyl)butanamide
CID 159841934
methanethiol;molecular hydrogen;5-oxo-N-propylhexanamide
CID 178099887
N,N'-bis(2-methoxyethyl)hexanediamide
CID 2933923
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-oxobutyl)hexanamide?
The IUPAC name of 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide (CID 59567342) is 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide.
What is the SMILES notation for 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide?
The canonical SMILES for 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide is COCC(=O)CCCC(=O)NCCC(C)=O.
What is the InChIKey of 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide?
The InChIKey is DJEUBCXYKBDSBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO4/c1-9(13)6-7-12-11(15)5-3-4-10(14)8-16-2/h3-8H2,1-2H3,(H,12,15).
What are the key properties of 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide?
6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide has a molecular weight of 229.28 g/mol, XLogP of 0.47, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5-oxo-N-(3-oxobutyl)hexanamide is sourced from PubChem (CID 59567342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).