2-[2-(ethylamino)ethyl]benzamide

C11H16N2O — CID 70462261

IUPAC2-[2-(ethylamino)ethyl]benzamide
SMILESCCNCCc1ccccc1C(N)=O
InChIInChI=1S/C11H16N2O/c1-2-13-8-7-9-5-3-4-6-10(9)11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyIUKRCUDNCHJSEK-UHFFFAOYSA-N
MW192.26 g/mol
LogP0.94
Rot. Bonds5

About 2-[2-(ethylamino)ethyl]benzamide

2-[2-(ethylamino)ethyl]benzamide (PubChem CID 70462261) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is 2-[2-(ethylamino)ethyl]benzamide.

Molecular Properties

Compound Name2-[2-(ethylamino)ethyl]benzamide
PubChem CID70462261
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Name2-[2-(ethylamino)ethyl]benzamide
SMILESCCNCCc1ccccc1C(N)=O
InChIInChI=1S/C11H16N2O/c1-2-13-8-7-9-5-3-4-6-10(9)11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14)
InChIKeyIUKRCUDNCHJSEK-UHFFFAOYSA-N
XLogP0.94
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(methylamino)ethyl]benzamide
CID 69094527
2-[2-(butanoylamino)ethyl]benzamide
CID 66868335
2-butylbenzamide
CID 15468173
2-octylbenzamide
CID 11148995
2-(2-benzamidoethyl)benzamide
CID 173153264
2-[[(4-ethylphenyl)methylamino]methyl]benzamide
CID 106899663
2-[3-(ethylamino)propylamino]benzamide
CID 61020118
2-[2-(ethylamino)ethyl]phenol;hydrochloride
CID 68825944
2-propylbenzohydrazide
CID 140653675
2-(3-chloropropyl)benzamide
CID 135741565
2-[2-(pentylamino)ethyl]benzoic acid
CID 104546845
N-[2-(ethylamino)ethyl]-2-(2-phenylethyl)benzamide;hydrochloride
CID 119507829

Frequently Asked Questions

What is the IUPAC name of 2-[2-(ethylamino)ethyl]benzamide?
The IUPAC name of 2-[2-(ethylamino)ethyl]benzamide (CID 70462261) is 2-[2-(ethylamino)ethyl]benzamide.
What is the SMILES notation for 2-[2-(ethylamino)ethyl]benzamide?
The canonical SMILES for 2-[2-(ethylamino)ethyl]benzamide is CCNCCc1ccccc1C(N)=O.
What is the InChIKey of 2-[2-(ethylamino)ethyl]benzamide?
The InChIKey is IUKRCUDNCHJSEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O/c1-2-13-8-7-9-5-3-4-6-10(9)11(12)14/h3-6,13H,2,7-8H2,1H3,(H2,12,14).
What are the key properties of 2-[2-(ethylamino)ethyl]benzamide?
2-[2-(ethylamino)ethyl]benzamide has a molecular weight of 192.26 g/mol, XLogP of 0.94, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(ethylamino)ethyl]benzamide is sourced from PubChem (CID 70462261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).