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

C13H20N2O2 — CID 82724577

IUPAC2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCCNc1ccccc1C(=O)NOC(C)(C)C
InChIInChI=1S/C13H20N2O2/c1-5-14-11-9-7-6-8-10(11)12(16)15-17-13(2,3)4/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyIASZTPPGYXBDMZ-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.58
Rot. Bonds4

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

2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide (PubChem CID 82724577) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide
PubChem CID82724577
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide
SMILESCCNc1ccccc1C(=O)NOC(C)(C)C
InChIInChI=1S/C13H20N2O2/c1-5-14-11-9-7-6-8-10(11)12(16)15-17-13(2,3)4/h6-9,14H,5H2,1-4H3,(H,15,16)
InChIKeyIASZTPPGYXBDMZ-UHFFFAOYSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(ethylamino)-N-(2-methylpropoxy)benzamide
CID 82723063
ethyl 2-[[2-(ethylamino)benzoyl]amino]acetate
CID 55177471
2-[[2-(ethylamino)benzoyl]amino]benzamide
CID 63107722
methyl (2S)-2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63107958
N-(4-amino-2-methyl-4-oxobutan-2-yl)-2-(ethylamino)benzamide
CID 106097445
ethyl 2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63108435
2-[[2-(ethylamino)benzoyl]amino]benzoic acid
CID 14221255
2-(ethylamino)-N-(2-hydroxy-2-methylbutyl)benzamide
CID 65109341
2-(ethylamino)-N-(2-fluorophenyl)benzamide
CID 55042608
N-(4-aminobutyl)-2-(ethylamino)benzamide
CID 55178434
methyl 2-[[2-(ethylamino)benzoyl]amino]-3-methylpentanoate
CID 63107982
[2-(ethylamino)phenyl]-phenylmethanone
CID 3661027

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide?
The IUPAC name of 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide (CID 82724577) is 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide.
What is the SMILES notation for 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide?
The canonical SMILES for 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide is CCNc1ccccc1C(=O)NOC(C)(C)C.
What is the InChIKey of 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide?
The InChIKey is IASZTPPGYXBDMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-5-14-11-9-7-6-8-10(11)12(16)15-17-13(2,3)4/h6-9,14H,5H2,1-4H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide?
2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide has a molecular weight of 236.31 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-[(2-methylpropan-2-yl)oxy]benzamide is sourced from PubChem (CID 82724577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).