N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide

C18H20N2O2 — CID 8699091

IUPACN-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide
SMILESCCc1ccccc1NC(=O)CNC(=O)c1cccc(C)c1
InChIInChI=1S/C18H20N2O2/c1-3-14-8-4-5-10-16(14)20-17(21)12-19-18(22)15-9-6-7-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyANGUJYDSOWQGMS-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.93
Rot. Bonds5

About N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide

N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide (PubChem CID 8699091) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide.

Molecular Properties

Compound NameN-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide
PubChem CID8699091
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC NameN-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide
SMILESCCc1ccccc1NC(=O)CNC(=O)c1cccc(C)c1
InChIInChI=1S/C18H20N2O2/c1-3-14-8-4-5-10-16(14)20-17(21)12-19-18(22)15-9-6-7-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21)
InChIKeyANGUJYDSOWQGMS-UHFFFAOYSA-N
XLogP2.93
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(2-chloroanilino)-2-oxoethyl]-3-methylbenzamide
CID 9411308
N-[2-(2-ethylanilino)-2-oxoethyl]naphthalene-2-carboxamide
CID 8699030
3,5-dichloro-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 27762230
4-ethyl-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26678506
N-[2-(2-hydroxy-4-methylanilino)-2-oxoethyl]-3-methylbenzamide
CID 9495518
N-[2-(2-ethylanilino)-2-oxoethyl]-3-(tetrazol-1-yl)benzamide
CID 31303419
4-(carbamoylamino)-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26076497
N-[2-(2,4-difluoroanilino)-2-oxoethyl]-3-methylbenzamide
CID 9165041
N-[2-(4-chloro-2-methylanilino)-2-oxoethyl]-3-methylbenzamide
CID 26666234
N-[2-(chloromethyl)phenyl]-3-methylbenzamide
CID 113271945
4-bromo-N-[2-(2-ethylanilino)-2-oxoethyl]-3,5-dimethoxybenzamide
CID 26707249
4-chloro-N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylsulfonylbenzamide
CID 26678437

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide?
The IUPAC name of N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide (CID 8699091) is N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide.
What is the SMILES notation for N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide?
The canonical SMILES for N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide is CCc1ccccc1NC(=O)CNC(=O)c1cccc(C)c1.
What is the InChIKey of N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide?
The InChIKey is ANGUJYDSOWQGMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-3-14-8-4-5-10-16(14)20-17(21)12-19-18(22)15-9-6-7-13(2)11-15/h4-11H,3,12H2,1-2H3,(H,19,22)(H,20,21).
What are the key properties of N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide?
N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide has a molecular weight of 296.37 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylanilino)-2-oxoethyl]-3-methylbenzamide is sourced from PubChem (CID 8699091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).