N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide

C19H23N3O2 — CID 54820940

IUPACN-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide
SMILESCCNCC(=O)Nc1ccc(C(=O)N(CC)c2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-3-20-14-18(23)21-16-12-10-15(11-13-16)19(24)22(4-2)17-8-6-5-7-9-17/h5-13,20H,3-4,14H2,1-2H3,(H,21,23)
InChIKeyLVZOHYILBULPJO-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.90
Rot. Bonds7

About N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide

N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide (PubChem CID 54820940) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide.

Molecular Properties

Compound NameN-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide
PubChem CID54820940
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC NameN-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide
SMILESCCNCC(=O)Nc1ccc(C(=O)N(CC)c2ccccc2)cc1
InChIInChI=1S/C19H23N3O2/c1-3-20-14-18(23)21-16-12-10-15(11-13-16)19(24)22(4-2)17-8-6-5-7-9-17/h5-13,20H,3-4,14H2,1-2H3,(H,21,23)
InChIKeyLVZOHYILBULPJO-UHFFFAOYSA-N
XLogP2.90
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[[2-(butylamino)acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 54815388
4-[(2-cyanoacetyl)amino]-N-ethyl-N-phenylbenzamide
CID 168520814
N-ethyl-4-[[2-(4-methoxyanilino)acetyl]amino]-N-phenylbenzamide
CID 54812554
N,N-diethyl-4-[[2-(ethylamino)acetyl]amino]benzamide
CID 54820671
N-ethyl-N-phenyl-4-[[2-[3-(propanoylamino)anilino]acetyl]amino]benzamide
CID 54833295
N-tert-butyl-4-[[2-[4-[ethyl(phenyl)carbamoyl]anilino]-2-oxoethyl]amino]benzamide
CID 54834536
4-N-ethyl-1-N,4-N-diphenylbenzene-1,4-dicarboxamide
CID 109049216
propyl 4-[[2-[4-[ethyl(phenyl)carbamoyl]anilino]-2-oxoethyl]amino]benzoate
CID 54812803
N-[4-[ethyl(phenyl)carbamoyl]phenyl]-2-methylbenzamide
CID 1243669
4-[[2-[bis(prop-2-enyl)amino]acetyl]amino]-N-ethyl-N-phenylbenzamide
CID 54817927
N-ethyl-4-[[2-oxo-2-(4-prop-2-enoxyanilino)ethyl]amino]-N-phenylbenzamide
CID 54838593
N-ethyl-N-phenyl-4-[[2-(2-prop-2-enoxyanilino)acetyl]amino]benzamide
CID 54824329

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide?
The IUPAC name of N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide (CID 54820940) is N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide.
What is the SMILES notation for N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide?
The canonical SMILES for N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide is CCNCC(=O)Nc1ccc(C(=O)N(CC)c2ccccc2)cc1.
What is the InChIKey of N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide?
The InChIKey is LVZOHYILBULPJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-3-20-14-18(23)21-16-12-10-15(11-13-16)19(24)22(4-2)17-8-6-5-7-9-17/h5-13,20H,3-4,14H2,1-2H3,(H,21,23).
What are the key properties of N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide?
N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide has a molecular weight of 325.41 g/mol, XLogP of 2.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[[2-(ethylamino)acetyl]amino]-N-phenylbenzamide is sourced from PubChem (CID 54820940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).