N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide

C15H23N3O2 — CID 54820671

IUPACN,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
SMILESCCNCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1
InChIInChI=1S/C15H23N3O2/c1-4-16-11-14(19)17-13-9-7-12(8-10-13)15(20)18(5-2)6-3/h7-10,16H,4-6,11H2,1-3H3,(H,17,19)
InChIKeyNWXYQTNQUZLYLC-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.72
Rot. Bonds7

About N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide

N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide (PubChem CID 54820671) has the molecular formula C15H23N3O2 and a molecular weight of 277.37 g/mol. Its IUPAC name is N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide.

Molecular Properties

Compound NameN,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
PubChem CID54820671
Molecular FormulaC15H23N3O2
Molecular Weight277.37 g/mol
Exact Mass277.18
IUPAC NameN,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
SMILESCCNCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1
InChIInChI=1S/C15H23N3O2/c1-4-16-11-14(19)17-13-9-7-12(8-10-13)15(20)18(5-2)6-3/h7-10,16H,4-6,11H2,1-3H3,(H,17,19)
InChIKeyNWXYQTNQUZLYLC-UHFFFAOYSA-N
XLogP1.72
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(butylamino)acetyl]amino]-N,N-diethylbenzamide
CID 54815634
N,N-diethyl-4-[[2-(prop-2-ynylamino)acetyl]amino]benzamide
CID 78908465
N,N-diethyl-4-[[2-(hexadecylamino)acetyl]amino]benzamide
CID 54808879
4-[[2-(dimethylamino)acetyl]amino]-N,N-diethylbenzamide
CID 54843896
N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide
CID 54820940
4-[[2-(4-bromoanilino)-2-oxoethyl]amino]-N,N-diethylbenzamide
CID 54834198
N,N-diethyl-4-[[2-(4-iodoanilino)acetyl]amino]benzamide
CID 54812461
N,N'-bis[4-(diethylcarbamoyl)phenyl]decanediamide
CID 17196837
4-[(2-aminoacetyl)amino]-N,N-diethylbenzamide;hydrochloride
CID 119268389
4-[[2-[(2-chlorophenyl)methylamino]acetyl]amino]-N,N-diethylbenzamide
CID 54832867
N-[4-(diethylamino)phenyl]-2-(ethylamino)acetamide
CID 60641172
4-[[2-[4-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-methylbenzamide
CID 54846187

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide?
The IUPAC name of N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide (CID 54820671) is N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide.
What is the SMILES notation for N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide?
The canonical SMILES for N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide is CCNCC(=O)Nc1ccc(C(=O)N(CC)CC)cc1.
What is the InChIKey of N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide?
The InChIKey is NWXYQTNQUZLYLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O2/c1-4-16-11-14(19)17-13-9-7-12(8-10-13)15(20)18(5-2)6-3/h7-10,16H,4-6,11H2,1-3H3,(H,17,19).
What are the key properties of N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide?
N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide has a molecular weight of 277.37 g/mol, XLogP of 1.72, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide is sourced from PubChem (CID 54820671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).