4-amino-N-(2-ethoxy-2-methylpropyl)benzamide

C13H20N2O2 — CID 114940355

IUPAC4-amino-N-(2-ethoxy-2-methylpropyl)benzamide
SMILESCCOC(C)(C)CNC(=O)c1ccc(N)cc1
InChIInChI=1S/C13H20N2O2/c1-4-17-13(2,3)9-15-12(16)10-5-7-11(14)8-6-10/h5-8H,4,9,14H2,1-3H3,(H,15,16)
InChIKeyDFLCGFNPIBHFOQ-UHFFFAOYSA-N
MW236.31 g/mol
LogP1.81
Rot. Bonds5

About 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide

4-amino-N-(2-ethoxy-2-methylpropyl)benzamide (PubChem CID 114940355) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-amino-N-(2-ethoxy-2-methylpropyl)benzamide
PubChem CID114940355
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name4-amino-N-(2-ethoxy-2-methylpropyl)benzamide
SMILESCCOC(C)(C)CNC(=O)c1ccc(N)cc1
InChIInChI=1S/C13H20N2O2/c1-4-17-13(2,3)9-15-12(16)10-5-7-11(14)8-6-10/h5-8H,4,9,14H2,1-3H3,(H,15,16)
InChIKeyDFLCGFNPIBHFOQ-UHFFFAOYSA-N
XLogP1.81
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-aminophenyl)-N-(2-ethoxy-2-methylpropyl)-2-methylpropanamide
CID 114942256
6-amino-N-(2-ethoxy-2-methylpropyl)pyridine-3-carboxamide
CID 114944068
4-amino-3-chloro-N-(2-ethoxy-2-methylpropyl)benzamide
CID 114940306
N-(2-ethoxy-2-methylpropyl)-6-oxo-1H-pyridine-3-carboxamide
CID 114942665
ethyl 2-[[2-[(4-aminobenzoyl)amino]acetyl]amino]acetate
CID 60895921
2-amino-6-chloro-N-(2-ethoxy-2-methylpropyl)pyridine-4-carboxamide
CID 114944144
2-amino-N-(2-ethoxy-2-methylpropyl)-6-methylbenzamide
CID 114940283
5-[(2-ethoxy-2-methylpropyl)carbamoyl]-2-methylbenzenesulfonyl chloride
CID 114944525
4-amino-N-ethoxybenzamide
CID 62058413
4-amino-N-(2-ethoxy-2-methylpropyl)-1,2,5-oxadiazole-3-carboxamide
CID 114942314
4-amino-N-(2-cyclopentyl-2-methylpropyl)benzamide
CID 115161070
5-amino-N-(2-ethoxy-2-methylpropyl)-2,4-difluorobenzamide
CID 114940280

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide?
The IUPAC name of 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide (CID 114940355) is 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide.
What is the SMILES notation for 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide?
The canonical SMILES for 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide is CCOC(C)(C)CNC(=O)c1ccc(N)cc1.
What is the InChIKey of 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide?
The InChIKey is DFLCGFNPIBHFOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-17-13(2,3)9-15-12(16)10-5-7-11(14)8-6-10/h5-8H,4,9,14H2,1-3H3,(H,15,16).
What are the key properties of 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide?
4-amino-N-(2-ethoxy-2-methylpropyl)benzamide has a molecular weight of 236.31 g/mol, XLogP of 1.81, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-ethoxy-2-methylpropyl)benzamide is sourced from PubChem (CID 114940355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).