4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride

C13H20ClN3O2 — CID 119268389

IUPAC4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
SMILESCCN(CC)C(=O)c1ccc(NC(=O)CN)cc1.Cl
InChIInChI=1S/C13H19N3O2.ClH/c1-3-16(4-2)13(18)10-5-7-11(8-6-10)15-12(17)9-14;/h5-8H,3-4,9,14H2,1-2H3,(H,15,17);1H
InChIKeyPDDMQIYMLTUYIE-UHFFFAOYSA-N
MW285.78 g/mol
LogP1.49
Rot. Bonds5

About 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride

4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride (PubChem CID 119268389) has the molecular formula C13H20ClN3O2 and a molecular weight of 285.78 g/mol. Its IUPAC name is 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride.

Molecular Properties

Compound Name4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
PubChem CID119268389
Molecular FormulaC13H20ClN3O2
Molecular Weight285.78 g/mol
Exact Mass285.12
IUPAC Name4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
SMILESCCN(CC)C(=O)c1ccc(NC(=O)CN)cc1.Cl
InChIInChI=1S/C13H19N3O2.ClH/c1-3-16(4-2)13(18)10-5-7-11(8-6-10)15-12(17)9-14;/h5-8H,3-4,9,14H2,1-2H3,(H,15,17);1H
InChIKeyPDDMQIYMLTUYIE-UHFFFAOYSA-N
XLogP1.49
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.78
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(2-aminoacetyl)amino]-N,N-dipropylbenzamide
CID 119282805
4-[[2-(dimethylamino)acetyl]amino]-N,N-diethylbenzamide
CID 54843896
N,N'-bis[4-(diethylcarbamoyl)phenyl]decanediamide
CID 17196837
N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
CID 54820671
N,N-diethyl-4-[[2-(4-methylphenoxy)acetyl]amino]benzamide
CID 7817272
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl] 4-acetamidobenzoate
CID 7957923
4-[(3-amino-3-phenylpropanoyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119948922
4-[(1-aminocyclopropanecarbonyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119684141
[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl] 4-hydroxybenzoate
CID 7777347
N,N-diethyl-4-[[2-(4-ethylphenoxy)acetyl]amino]benzamide
CID 8503993
4-[3-(2-aminophenyl)propanoylamino]-N,N-diethylbenzamide;hydrochloride
CID 120608128
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426

Frequently Asked Questions

What is the IUPAC name of 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride?
The IUPAC name of 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride (CID 119268389) is 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride.
What is the SMILES notation for 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride?
The canonical SMILES for 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride is CCN(CC)C(=O)c1ccc(NC(=O)CN)cc1.Cl.
What is the InChIKey of 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride?
The InChIKey is PDDMQIYMLTUYIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O2.ClH/c1-3-16(4-2)13(18)10-5-7-11(8-6-10)15-12(17)9-14;/h5-8H,3-4,9,14H2,1-2H3,(H,15,17);1H.
What are the key properties of 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride?
4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride has a molecular weight of 285.78 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride is sourced from PubChem (CID 119268389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).