3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide

C19H23N3O2 — CID 54838010

IUPAC3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(NCC(=O)Nc2cccc(C)c2C)c1
InChIInChI=1S/C19H23N3O2/c1-4-20-19(24)15-8-6-9-16(11-15)21-12-18(23)22-17-10-5-7-13(2)14(17)3/h5-11,21H,4,12H2,1-3H3,(H,20,24)(H,22,23)
InChIKeyYDNMARLPEVJRHM-UHFFFAOYSA-N
MW325.41 g/mol
LogP3.10
Rot. Bonds6

About 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide

3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide (PubChem CID 54838010) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide.

Molecular Properties

Compound Name3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide
PubChem CID54838010
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide
SMILESCCNC(=O)c1cccc(NCC(=O)Nc2cccc(C)c2C)c1
InChIInChI=1S/C19H23N3O2/c1-4-20-19(24)15-8-6-9-16(11-15)21-12-18(23)22-17-10-5-7-13(2)14(17)3/h5-11,21H,4,12H2,1-3H3,(H,20,24)(H,22,23)
InChIKeyYDNMARLPEVJRHM-UHFFFAOYSA-N
XLogP3.10
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.10
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-(2-methoxyethyl)benzamide
CID 54836295
N-tert-butyl-3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]benzamide
CID 54844261
N-ethyl-3-[[2-[2-methyl-3-(propanoylamino)anilino]acetyl]amino]benzamide
CID 34078183
3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-(furan-2-ylmethyl)benzamide
CID 54834540
N-ethyl-3-[[2-(2-methoxyanilino)-2-oxoethyl]amino]benzamide
CID 54838041
3-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-N-ethylbenzamide
CID 54837717
N-tert-butyl-3-[[2-[3-(ethylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54844494
N-ethyl-3-[[2-[4-(methylcarbamoyl)anilino]-2-oxoethyl]amino]benzamide
CID 54837724
3-[[2-[3-(diethylcarbamoyl)anilino]-2-oxoethyl]amino]-N-ethylbenzamide
CID 54837721
N-ethyl-4-[[2-[2-methyl-3-(propanoylamino)anilino]-2-oxoethyl]amino]benzamide
CID 54839477
3-[[2-[2-(2-ethoxyethoxy)anilino]-2-oxoethyl]amino]-N-ethylbenzamide
CID 54837835
N-(3-methoxypropyl)-3-[[2-[2-methyl-3-(propanoylamino)anilino]-2-oxoethyl]amino]benzamide
CID 54842675

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide?
The IUPAC name of 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide (CID 54838010) is 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide.
What is the SMILES notation for 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide?
The canonical SMILES for 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide is CCNC(=O)c1cccc(NCC(=O)Nc2cccc(C)c2C)c1.
What is the InChIKey of 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide?
The InChIKey is YDNMARLPEVJRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-20-19(24)15-8-6-9-16(11-15)21-12-18(23)22-17-10-5-7-13(2)14(17)3/h5-11,21H,4,12H2,1-3H3,(H,20,24)(H,22,23).
What are the key properties of 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide?
3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide has a molecular weight of 325.41 g/mol, XLogP of 3.10, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(2,3-dimethylanilino)-2-oxoethyl]amino]-N-ethylbenzamide is sourced from PubChem (CID 54838010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).