2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide

C13H20N2O2 — CID 113450456

IUPAC2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide
SMILESCNc1ccccc1C(=O)NCCOC(C)C
InChIInChI=1S/C13H20N2O2/c1-10(2)17-9-8-15-13(16)11-6-4-5-7-12(11)14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16)
InChIKeyZPKPUANTEMAYNG-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.88
Rot. Bonds6

About 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide

2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide (PubChem CID 113450456) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide.

Molecular Properties

Compound Name2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide
PubChem CID113450456
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide
SMILESCNc1ccccc1C(=O)NCCOC(C)C
InChIInChI=1S/C13H20N2O2/c1-10(2)17-9-8-15-13(16)11-6-4-5-7-12(11)14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16)
InChIKeyZPKPUANTEMAYNG-UHFFFAOYSA-N
XLogP1.88
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(ethylamino)-N-(2-propan-2-yloxyethyl)benzamide
CID 113450457
4-methyl-2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide
CID 104765563
2-(methylamino)-N-(4-methylpentyl)benzamide
CID 61377674
2-propan-2-yloxyethyl 2-(methylamino)benzoate
CID 60643656
2-(2-propan-2-yloxyethylcarbamoyl)pyridine-3-carboxylic acid
CID 104759073
3-amino-2-methyl-N-(2-propan-2-yloxyethyl)benzamide
CID 113449772
N-(2-propan-2-yloxyethyl)-2-(propylamino)pyridine-3-carboxamide
CID 104765522
2-amino-N-(3-propan-2-yloxypropyl)benzamide
CID 61249223
2-(2-propan-2-yloxyethylamino)benzamide
CID 141361883
2-(methylamino)-N-[2-(methylsulfamoyl)ethyl]benzamide
CID 114175674
3-[[2-(methylamino)benzoyl]amino]propyl prop-2-ynoate
CID 53468564
2,3-difluoro-N-(3-propan-2-yloxypropyl)benzamide
CID 62662327

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide?
The IUPAC name of 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide (CID 113450456) is 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide.
What is the SMILES notation for 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide?
The canonical SMILES for 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide is CNc1ccccc1C(=O)NCCOC(C)C.
What is the InChIKey of 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide?
The InChIKey is ZPKPUANTEMAYNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-10(2)17-9-8-15-13(16)11-6-4-5-7-12(11)14-3/h4-7,10,14H,8-9H2,1-3H3,(H,15,16).
What are the key properties of 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide?
2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide has a molecular weight of 236.31 g/mol, XLogP of 1.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-(2-propan-2-yloxyethyl)benzamide is sourced from PubChem (CID 113450456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).