3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide

C19H23N3O3 — CID 29458921

IUPAC3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide
SMILESCCOc1ccccc1NCC(=O)Nc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-4-25-17-11-6-5-10-16(17)20-13-18(23)21-15-9-7-8-14(12-15)19(24)22(2)3/h5-12,20H,4,13H2,1-3H3,(H,21,23)
InChIKeyUHFBUQIAKOEMAN-UHFFFAOYSA-N
MW341.41 g/mol
LogP2.84
Rot. Bonds7

About 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide

3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide (PubChem CID 29458921) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide
PubChem CID29458921
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC Name3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide
SMILESCCOc1ccccc1NCC(=O)Nc1cccc(C(=O)N(C)C)c1
InChIInChI=1S/C19H23N3O3/c1-4-25-17-11-6-5-10-16(17)20-13-18(23)21-15-9-7-8-14(12-15)19(24)22(2)3/h5-12,20H,4,13H2,1-3H3,(H,21,23)
InChIKeyUHFBUQIAKOEMAN-UHFFFAOYSA-N
XLogP2.84
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[[2-(3-ethoxyanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 54840596
3-[[2-[2-(2,6-dimethylphenoxy)anilino]acetyl]amino]-N,N-dimethylbenzamide
CID 60587775
2-(2-ethoxyanilino)-N-(3-ethoxyphenyl)acetamide
CID 54817200
3-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]-N,N-dimethylpropanamide
CID 54817351
3-[[2-[2-(2-ethoxyethoxy)anilino]acetyl]amino]-N,N-dipropylbenzamide
CID 54827668
N-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]-2-methylpropanamide
CID 54817227
N-benzyl-N-methyl-3-[[2-(2-phenylmethoxyanilino)acetyl]amino]benzamide
CID 54828122
N-(3-cyanophenyl)-2-(2-ethoxyanilino)acetamide
CID 9102058
N-[3-[[2-(2-ethoxyanilino)acetyl]amino]phenyl]hexanamide
CID 54817487
3-[[2-(2-prop-2-enoxyanilino)acetyl]amino]-N,N-dipropylbenzamide
CID 54824667
N-methyl-3-[[2-[2-(2-methylprop-2-enoxy)anilino]acetyl]amino]-N-phenylbenzamide
CID 54826156
3-[[2-(2,6-dimethylanilino)acetyl]amino]-N,N-dimethylbenzamide
CID 32908676

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide?
The IUPAC name of 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide (CID 29458921) is 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide?
The canonical SMILES for 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide is CCOc1ccccc1NCC(=O)Nc1cccc(C(=O)N(C)C)c1.
What is the InChIKey of 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide?
The InChIKey is UHFBUQIAKOEMAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-4-25-17-11-6-5-10-16(17)20-13-18(23)21-15-9-7-8-14(12-15)19(24)22(2)3/h5-12,20H,4,13H2,1-3H3,(H,21,23).
What are the key properties of 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide?
3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide has a molecular weight of 341.41 g/mol, XLogP of 2.84, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2-ethoxyanilino)acetyl]amino]-N,N-dimethylbenzamide is sourced from PubChem (CID 29458921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).