2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide

C19H21N3O4 — CID 46510511

IUPAC2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)Nc1cccc(C(=O)NC)c1
InChIInChI=1S/C19H21N3O4/c1-3-26-16-10-5-4-9-15(16)19(25)21-12-17(23)22-14-8-6-7-13(11-14)18(24)20-2/h4-11H,3,12H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)
InChIKeyHNLBRWMGNFMJIV-UHFFFAOYSA-N
MW355.39 g/mol
LogP1.81
Rot. Bonds7

About 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide

2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide (PubChem CID 46510511) has the molecular formula C19H21N3O4 and a molecular weight of 355.39 g/mol. Its IUPAC name is 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide
PubChem CID46510511
Molecular FormulaC19H21N3O4
Molecular Weight355.39 g/mol
Exact Mass355.15
IUPAC Name2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide
SMILESCCOc1ccccc1C(=O)NCC(=O)Nc1cccc(C(=O)NC)c1
InChIInChI=1S/C19H21N3O4/c1-3-26-16-10-5-4-9-15(16)19(25)21-12-17(23)22-14-8-6-7-13(11-14)18(24)20-2/h4-11H,3,12H2,1-2H3,(H,20,24)(H,21,25)(H,22,23)
InChIKeyHNLBRWMGNFMJIV-UHFFFAOYSA-N
XLogP1.81
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.39
LogP ≤ 51.81
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethoxy-N-[2-(3-methylsulfonylanilino)-2-oxoethyl]benzamide
CID 9071303
2-ethoxy-N-[3-[(3-methylphenyl)carbamoyl]phenyl]benzamide
CID 1228354
N-[2-(3-chloro-4-fluoroanilino)-2-oxoethyl]-2-ethoxybenzamide
CID 9165970
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
N-[4-(3-acetylanilino)-4-oxobutyl]-2-ethoxybenzamide
CID 9078863
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
2-ethoxy-N-[3-(2-methoxyethylcarbamoyl)phenyl]benzamide
CID 17219003
2-hexoxy-N-[3-(methylcarbamoyl)phenyl]benzamide
CID 17233105
N-[3-(benzylcarbamoyl)phenyl]-2-ethoxybenzamide
CID 28638874
[2-(3-acetamidoanilino)-2-oxoethyl] 2-[(2-ethoxybenzoyl)amino]acetate
CID 7807711
3,5-dimethyl-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide
CID 18146235
3-[[2-(4-ethoxyanilino)acetyl]amino]-N-methylbenzamide
CID 54811072

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide?
The IUPAC name of 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide (CID 46510511) is 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide is CCOc1ccccc1C(=O)NCC(=O)Nc1cccc(C(=O)NC)c1.
What is the InChIKey of 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide?
The InChIKey is HNLBRWMGNFMJIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O4/c1-3-26-16-10-5-4-9-15(16)19(25)21-12-17(23)22-14-8-6-7-13(11-14)18(24)20-2/h4-11H,3,12H2,1-2H3,(H,20,24)(H,21,25)(H,22,23).
What are the key properties of 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide?
2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide has a molecular weight of 355.39 g/mol, XLogP of 1.81, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[2-[3-(methylcarbamoyl)anilino]-2-oxoethyl]benzamide is sourced from PubChem (CID 46510511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).