N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide

C14H25NO3 — CID 54413820

IUPACN,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide
SMILESCC(=O)C(C)N(C)C(=O)C(C)C(C)C(=O)C(C)C
InChIInChI=1S/C14H25NO3/c1-8(2)13(17)9(3)10(4)14(18)15(7)11(5)12(6)16/h8-11H,1-7H3
InChIKeyVVYYEKKZORTMLQ-UHFFFAOYSA-N
MW255.36 g/mol
LogP1.92
Rot. Bonds6

About N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide

N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide (PubChem CID 54413820) has the molecular formula C14H25NO3 and a molecular weight of 255.36 g/mol. Its IUPAC name is N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide.

Molecular Properties

Compound NameN,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide
PubChem CID54413820
Molecular FormulaC14H25NO3
Molecular Weight255.36 g/mol
Exact Mass255.18
IUPAC NameN,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide
SMILESCC(=O)C(C)N(C)C(=O)C(C)C(C)C(=O)C(C)C
InChIInChI=1S/C14H25NO3/c1-8(2)13(17)9(3)10(4)14(18)15(7)11(5)12(6)16/h8-11H,1-7H3
InChIKeyVVYYEKKZORTMLQ-UHFFFAOYSA-N
XLogP1.92
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 51.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide?
The IUPAC name of N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide (CID 54413820) is N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide.
What is the SMILES notation for N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide?
The canonical SMILES for N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide is CC(=O)C(C)N(C)C(=O)C(C)C(C)C(=O)C(C)C.
What is the InChIKey of N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide?
The InChIKey is VVYYEKKZORTMLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO3/c1-8(2)13(17)9(3)10(4)14(18)15(7)11(5)12(6)16/h8-11H,1-7H3.
What are the key properties of N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide?
N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide has a molecular weight of 255.36 g/mol, XLogP of 1.92, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,2,3,5-tetramethyl-4-oxo-N-(3-oxobutan-2-yl)hexanamide is sourced from PubChem (CID 54413820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).