2-(ethylamino)-N-(2-methylpropoxy)benzamide

C13H20N2O2 — CID 82723063

IUPAC2-(ethylamino)-N-(2-methylpropoxy)benzamide
SMILESCCNc1ccccc1C(=O)NOCC(C)C
InChIInChI=1S/C13H20N2O2/c1-4-14-12-8-6-5-7-11(12)13(16)15-17-9-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyARJJGMJYLRJRRU-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.44
Rot. Bonds6

About 2-(ethylamino)-N-(2-methylpropoxy)benzamide

2-(ethylamino)-N-(2-methylpropoxy)benzamide (PubChem CID 82723063) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-(ethylamino)-N-(2-methylpropoxy)benzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(2-methylpropoxy)benzamide
PubChem CID82723063
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-(ethylamino)-N-(2-methylpropoxy)benzamide
SMILESCCNc1ccccc1C(=O)NOCC(C)C
InChIInChI=1S/C13H20N2O2/c1-4-14-12-8-6-5-7-11(12)13(16)15-17-9-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16)
InChIKeyARJJGMJYLRJRRU-UHFFFAOYSA-N
XLogP2.44
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 ≤ 52.44
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-methylpropan-2-yl)oxy]benzamide
CID 82724577
methyl (2S)-2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63107958
ethyl 2-[[2-(ethylamino)benzoyl]amino]propanoate
CID 63108435
2,3-dihydroxy-N-(2-methylpropoxy)benzamide
CID 114344886
methyl 2-[[2-(ethylamino)benzoyl]amino]-3-methylpentanoate
CID 63107982
2-(ethylamino)-N-(3-methoxy-2-methylpropyl)benzamide
CID 62175521
2-(ethylamino)-N-(2-propan-2-yloxyethyl)benzamide
CID 113450457
2-[[2-(ethylamino)benzoyl]amino]benzamide
CID 63107722
N-but-3-yn-2-yl-2-(ethylamino)benzamide
CID 114418246
2-(ethylamino)-N-methyl-N-(3-methylbutyl)benzamide
CID 62177256
3-bromo-2-methyl-N-(2-methylpropoxy)benzamide
CID 115409669
2-(ethylamino)-N-(2-phenylpropyl)benzamide
CID 63107799

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(2-methylpropoxy)benzamide?
The IUPAC name of 2-(ethylamino)-N-(2-methylpropoxy)benzamide (CID 82723063) is 2-(ethylamino)-N-(2-methylpropoxy)benzamide.
What is the SMILES notation for 2-(ethylamino)-N-(2-methylpropoxy)benzamide?
The canonical SMILES for 2-(ethylamino)-N-(2-methylpropoxy)benzamide is CCNc1ccccc1C(=O)NOCC(C)C.
What is the InChIKey of 2-(ethylamino)-N-(2-methylpropoxy)benzamide?
The InChIKey is ARJJGMJYLRJRRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-14-12-8-6-5-7-11(12)13(16)15-17-9-10(2)3/h5-8,10,14H,4,9H2,1-3H3,(H,15,16).
What are the key properties of 2-(ethylamino)-N-(2-methylpropoxy)benzamide?
2-(ethylamino)-N-(2-methylpropoxy)benzamide has a molecular weight of 236.31 g/mol, XLogP of 2.44, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(2-methylpropoxy)benzamide is sourced from PubChem (CID 82723063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).