3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide

C19H23N3O2 — CID 54838774

IUPAC3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1cccc(NCC(=O)N(C)C)c1)c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-4-22(17-11-6-5-7-12-17)19(24)15-9-8-10-16(13-15)20-14-18(23)21(2)3/h5-13,20H,4,14H2,1-3H3
InChIKeyNIFOKHDPOHDVFF-UHFFFAOYSA-N
MW325.41 g/mol
LogP2.85
Rot. Bonds6

About 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide

3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide (PubChem CID 54838774) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide.

Molecular Properties

Compound Name3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide
PubChem CID54838774
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide
SMILESCCN(C(=O)c1cccc(NCC(=O)N(C)C)c1)c1ccccc1
InChIInChI=1S/C19H23N3O2/c1-4-22(17-11-6-5-7-12-17)19(24)15-9-8-10-16(13-15)20-14-18(23)21(2)3/h5-13,20H,4,14H2,1-3H3
InChIKeyNIFOKHDPOHDVFF-UHFFFAOYSA-N
XLogP2.85
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-[[2-(N-ethylanilino)-2-oxoethyl]amino]-N,N-dimethylbenzamide
CID 37257112
N-ethyl-N-phenyl-3-[[2-[3-(propanoylamino)anilino]acetyl]amino]benzamide
CID 54833237
3-acetamido-N-ethyl-N-phenylbenzamide
CID 17221925
N-ethyl-3-[[2-[3-[ethyl(phenyl)carbamoyl]anilino]acetyl]amino]benzamide
CID 54839058
N-ethyl-3-[[2-(4-methylanilino)acetyl]amino]-N-phenylbenzamide
CID 54814231
3-[[2-(2-chloroanilino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide
CID 54838651
N-ethyl-3-[[2-(naphthalen-1-ylamino)-2-oxoethyl]amino]-N-phenylbenzamide
CID 54838962
N-tert-butyl-3-[[2-(N-ethylanilino)-2-oxoethyl]amino]benzamide
CID 54844457
2-(3-acetamidoanilino)-N-ethyl-N-phenylacetamide
CID 37176169
N-[3-[ethyl(phenyl)carbamoyl]phenyl]pyridine-4-carboxamide
CID 17221980
4-[[2-[3-[3-(dimethylamino)-3-oxopropyl]anilino]-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide
CID 54838274
3-[[2-[3-[ethyl(phenyl)carbamoyl]anilino]acetyl]amino]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 54839033

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide?
The IUPAC name of 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide (CID 54838774) is 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide.
What is the SMILES notation for 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide?
The canonical SMILES for 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide is CCN(C(=O)c1cccc(NCC(=O)N(C)C)c1)c1ccccc1.
What is the InChIKey of 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide?
The InChIKey is NIFOKHDPOHDVFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-4-22(17-11-6-5-7-12-17)19(24)15-9-8-10-16(13-15)20-14-18(23)21(2)3/h5-13,20H,4,14H2,1-3H3.
What are the key properties of 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide?
3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide has a molecular weight of 325.41 g/mol, XLogP of 2.85, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(dimethylamino)-2-oxoethyl]amino]-N-ethyl-N-phenylbenzamide is sourced from PubChem (CID 54838774), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).