4-amino-N-[2-(diethylamino)ethyl]benzamide

C13H21N3O — CID 4913

💊View drug profile → procainamide
IUPAC4-amino-N-[2-(diethylamino)ethyl]benzamide
SMILESCCN(CC)CCNC(=O)c1ccc(N)cc1
InChIInChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)
InChIKeyREQCZEXYDRLIBE-UHFFFAOYSA-N
MW235.33 g/mol
LogP1.34
Rot. Bonds6

About 4-amino-N-[2-(diethylamino)ethyl]benzamide

4-amino-N-[2-(diethylamino)ethyl]benzamide (PubChem CID 4913) has the molecular formula C13H21N3O and a molecular weight of 235.33 g/mol. Its IUPAC name is 4-amino-N-[2-(diethylamino)ethyl]benzamide.

Molecular Properties

Compound Name4-amino-N-[2-(diethylamino)ethyl]benzamide
PubChem CID4913
Molecular FormulaC13H21N3O
Molecular Weight235.33 g/mol
Exact Mass235.17
IUPAC Name4-amino-N-[2-(diethylamino)ethyl]benzamide
SMILESCCN(CC)CCNC(=O)c1ccc(N)cc1
InChIInChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17)
InChIKeyREQCZEXYDRLIBE-UHFFFAOYSA-N
XLogP1.34
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 51.34
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

p-Aminohippuric acid
CID 2148
Procainamide Hydrochloride
CID 66068
N-Acetylprocainamide
CID 4342
Tacedinaline
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Balicatib
CID 10201696
Acecainide Hydrochloride
CID 71417
2-Amino-N-isopropylbenzamide
CID 94411
Dinaline
CID 42725
Declopramide
CID 70177
RG-2833
CID 56654642
N-[4-(1-oxopropyl)phenyl]acetamide
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4-amino-N,N-diethylbenzamide
CID 458760

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[2-(diethylamino)ethyl]benzamide?
The IUPAC name of 4-amino-N-[2-(diethylamino)ethyl]benzamide (CID 4913) is 4-amino-N-[2-(diethylamino)ethyl]benzamide.
What is the SMILES notation for 4-amino-N-[2-(diethylamino)ethyl]benzamide?
The canonical SMILES for 4-amino-N-[2-(diethylamino)ethyl]benzamide is CCN(CC)CCNC(=O)c1ccc(N)cc1.
What is the InChIKey of 4-amino-N-[2-(diethylamino)ethyl]benzamide?
The InChIKey is REQCZEXYDRLIBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O/c1-3-16(4-2)10-9-15-13(17)11-5-7-12(14)8-6-11/h5-8H,3-4,9-10,14H2,1-2H3,(H,15,17).
What are the key properties of 4-amino-N-[2-(diethylamino)ethyl]benzamide?
4-amino-N-[2-(diethylamino)ethyl]benzamide has a molecular weight of 235.33 g/mol, XLogP of 1.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-[2-(diethylamino)ethyl]benzamide is sourced from PubChem (CID 4913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).