2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide

C15H20N2O4 — CID 43426354

IUPAC2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide
SMILESCC(=O)C(NC(=O)COc1ccccc1C(N)=O)C(C)C
InChIInChI=1S/C15H20N2O4/c1-9(2)14(10(3)18)17-13(19)8-21-12-7-5-4-6-11(12)15(16)20/h4-7,9,14H,8H2,1-3H3,(H2,16,20)(H,17,19)
InChIKeyLTHTVWIOWVGTAB-UHFFFAOYSA-N
MW292.33 g/mol
LogP0.89
Rot. Bonds7

About 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide

2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide (PubChem CID 43426354) has the molecular formula C15H20N2O4 and a molecular weight of 292.33 g/mol. Its IUPAC name is 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide.

Molecular Properties

Compound Name2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide
PubChem CID43426354
Molecular FormulaC15H20N2O4
Molecular Weight292.33 g/mol
Exact Mass292.14
IUPAC Name2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide
SMILESCC(=O)C(NC(=O)COc1ccccc1C(N)=O)C(C)C
InChIInChI=1S/C15H20N2O4/c1-9(2)14(10(3)18)17-13(19)8-21-12-7-5-4-6-11(12)15(16)20/h4-7,9,14H,8H2,1-3H3,(H2,16,20)(H,17,19)
InChIKeyLTHTVWIOWVGTAB-UHFFFAOYSA-N
XLogP0.89
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.33
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide?
The IUPAC name of 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide (CID 43426354) is 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide.
What is the SMILES notation for 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide?
The canonical SMILES for 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide is CC(=O)C(NC(=O)COc1ccccc1C(N)=O)C(C)C.
What is the InChIKey of 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide?
The InChIKey is LTHTVWIOWVGTAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-9(2)14(10(3)18)17-13(19)8-21-12-7-5-4-6-11(12)15(16)20/h4-7,9,14H,8H2,1-3H3,(H2,16,20)(H,17,19).
What are the key properties of 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide?
2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide has a molecular weight of 292.33 g/mol, XLogP of 0.89, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide is sourced from PubChem (CID 43426354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).