N-[(2-methylpropan-2-yl)oxy]benzamide

C11H15NO2 — CID 4052036

IUPACN-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCC(C)(C)ONC(=O)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-11(2,3)14-12-10(13)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,12,13)
InChIKeyLQJUQIJUFSHFAS-UHFFFAOYSA-N
MW193.25 g/mol
LogP2.15
Rot. Bonds2

About N-[(2-methylpropan-2-yl)oxy]benzamide

N-[(2-methylpropan-2-yl)oxy]benzamide (PubChem CID 4052036) has the molecular formula C11H15NO2 and a molecular weight of 193.25 g/mol. Its IUPAC name is N-[(2-methylpropan-2-yl)oxy]benzamide.

Molecular Properties

Compound NameN-[(2-methylpropan-2-yl)oxy]benzamide
PubChem CID4052036
Molecular FormulaC11H15NO2
Molecular Weight193.25 g/mol
Exact Mass193.11
IUPAC NameN-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCC(C)(C)ONC(=O)c1ccccc1
InChIInChI=1S/C11H15NO2/c1-11(2,3)14-12-10(13)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,12,13)
InChIKeyLQJUQIJUFSHFAS-UHFFFAOYSA-N
XLogP2.15
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 52.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[(2-methylpropan-2-yl)oxy]benzamide?
The IUPAC name of N-[(2-methylpropan-2-yl)oxy]benzamide (CID 4052036) is N-[(2-methylpropan-2-yl)oxy]benzamide.
What is the SMILES notation for N-[(2-methylpropan-2-yl)oxy]benzamide?
The canonical SMILES for N-[(2-methylpropan-2-yl)oxy]benzamide is CC(C)(C)ONC(=O)c1ccccc1.
What is the InChIKey of N-[(2-methylpropan-2-yl)oxy]benzamide?
The InChIKey is LQJUQIJUFSHFAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO2/c1-11(2,3)14-12-10(13)9-7-5-4-6-8-9/h4-8H,1-3H3,(H,12,13).
What are the key properties of N-[(2-methylpropan-2-yl)oxy]benzamide?
N-[(2-methylpropan-2-yl)oxy]benzamide has a molecular weight of 193.25 g/mol, XLogP of 2.15, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methylpropan-2-yl)oxy]benzamide is sourced from PubChem (CID 4052036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).