2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide

C17H19N3O2 — CID 16606561

IUPAC2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide
SMILESCCc1ccc(NC(=O)CNc2ccccc2C(N)=O)cc1
InChIInChI=1S/C17H19N3O2/c1-2-12-7-9-13(10-8-12)20-16(21)11-19-15-6-4-3-5-14(15)17(18)22/h3-10,19H,2,11H2,1H3,(H2,18,22)(H,20,21)
InChIKeyQVBWZVHSNXQJJO-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.40
Rot. Bonds6

About 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide

2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide (PubChem CID 16606561) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide.

Molecular Properties

Compound Name2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide
PubChem CID16606561
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide
SMILESCCc1ccc(NC(=O)CNc2ccccc2C(N)=O)cc1
InChIInChI=1S/C17H19N3O2/c1-2-12-7-9-13(10-8-12)20-16(21)11-19-15-6-4-3-5-14(15)17(18)22/h3-10,19H,2,11H2,1H3,(H2,18,22)(H,20,21)
InChIKeyQVBWZVHSNXQJJO-UHFFFAOYSA-N
XLogP2.40
TPSA84.22 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 4-[[2-(2-carbamoylanilino)acetyl]amino]benzoate
CID 30637236
N-(4-ethylphenyl)-2-[[2-(2-fluoroanilino)-2-oxoethyl]amino]benzamide
CID 9106090
2-[[2-(4-butoxyanilino)-2-oxoethyl]amino]benzamide
CID 54811984
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-(4-ethylphenyl)benzamide
CID 9106065
2-(4-ethylanilino)benzamide
CID 177472959
3-[(2-anilino-2-oxoethyl)amino]-2-methylbenzamide
CID 60537419
2-[[2-(4-ethylanilino)-2-oxoethyl]amino]-5-piperidin-1-ylbenzamide
CID 18275278
2-[[2-[2-(difluoromethoxy)anilino]-2-oxoethyl]amino]-N-(4-ethylphenyl)benzamide
CID 2437754
ethyl 2-[[2-(4-acetylanilino)-2-oxoethyl]amino]benzoate
CID 109009916
2-[[2-(4-ethylanilino)-2-oxoethyl]amino]-N-[2-(4-methoxyphenyl)ethyl]benzamide
CID 18267087
2-[[2-(4-methylanilino)-2-oxoethyl]amino]-N-(4-methylphenyl)benzamide
CID 9106347
ethyl 2-[[2-oxo-2-(4-phenoxyanilino)ethyl]amino]benzoate
CID 109010741

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide?
The IUPAC name of 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide (CID 16606561) is 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide.
What is the SMILES notation for 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide?
The canonical SMILES for 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide is CCc1ccc(NC(=O)CNc2ccccc2C(N)=O)cc1.
What is the InChIKey of 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide?
The InChIKey is QVBWZVHSNXQJJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-2-12-7-9-13(10-8-12)20-16(21)11-19-15-6-4-3-5-14(15)17(18)22/h3-10,19H,2,11H2,1H3,(H2,18,22)(H,20,21).
What are the key properties of 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide?
2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide has a molecular weight of 297.36 g/mol, XLogP of 2.40, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-(4-ethylanilino)-2-oxoethyl]amino]benzamide is sourced from PubChem (CID 16606561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).