N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide

C23H31N3O2 — CID 112799196

IUPACN-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide
SMILESCCCc1ccc(NC(C)C(=O)N(C)CC(=O)Nc2ccccc2CC)cc1
InChIInChI=1S/C23H31N3O2/c1-5-9-18-12-14-20(15-13-18)24-17(3)23(28)26(4)16-22(27)25-21-11-8-7-10-19(21)6-2/h7-8,10-15,17,24H,5-6,9,16H2,1-4H3,(H,25,27)
InChIKeySPDFRPBGAJGWJT-UHFFFAOYSA-N
MW381.52 g/mol
LogP4.10
Rot. Bonds9

About N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide

N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide (PubChem CID 112799196) has the molecular formula C23H31N3O2 and a molecular weight of 381.52 g/mol. Its IUPAC name is N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide.

Molecular Properties

Compound NameN-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide
PubChem CID112799196
Molecular FormulaC23H31N3O2
Molecular Weight381.52 g/mol
Exact Mass381.24
IUPAC NameN-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide
SMILESCCCc1ccc(NC(C)C(=O)N(C)CC(=O)Nc2ccccc2CC)cc1
InChIInChI=1S/C23H31N3O2/c1-5-9-18-12-14-20(15-13-18)24-17(3)23(28)26(4)16-22(27)25-21-11-8-7-10-19(21)6-2/h7-8,10-15,17,24H,5-6,9,16H2,1-4H3,(H,25,27)
InChIKeySPDFRPBGAJGWJT-UHFFFAOYSA-N
XLogP4.10
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.52
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-bromo-3-methylanilino)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 112799144
N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-[4-(2-methyl-1,3-thiazol-4-yl)anilino]propanamide
CID 112799212
2-(4-butylphenyl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylacetamide
CID 46450100
2-[2-(dimethylamino)ethylsulfanyl]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 71856374
2-[1-(1-benzofuran-2-yl)ethylamino]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 112798745
2-amino-N-[2-(2-ethylanilino)-2-oxoethyl]-3-methoxy-N-methylpropanamide
CID 120983235
2-[(2-chlorophenyl)methyl-methylamino]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 55439456
(2S)-2-(5,7-dihydrobenzo[d][2]benzazepin-6-yl)-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 95345101
3-[4-(difluoromethoxy)phenyl]-N-[2-(2-ethylanilino)-2-oxoethyl]-N-methylpropanamide
CID 86922903
N-(2-ethylphenyl)-2-[(4-ethylphenyl)methyl-methylamino]acetamide
CID 27095559
2-[[(2S)-2,4-dimethylpentyl]-methylamino]-N-(2-ethylphenyl)acetamide
CID 100703004
N-(2-ethylphenyl)-2-[methyl-[(4-phenoxyphenyl)carbamoyl]amino]acetamide
CID 55696777

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide?
The IUPAC name of N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide (CID 112799196) is N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide.
What is the SMILES notation for N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide?
The canonical SMILES for N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide is CCCc1ccc(NC(C)C(=O)N(C)CC(=O)Nc2ccccc2CC)cc1.
What is the InChIKey of N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide?
The InChIKey is SPDFRPBGAJGWJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H31N3O2/c1-5-9-18-12-14-20(15-13-18)24-17(3)23(28)26(4)16-22(27)25-21-11-8-7-10-19(21)6-2/h7-8,10-15,17,24H,5-6,9,16H2,1-4H3,(H,25,27).
What are the key properties of N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide?
N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide has a molecular weight of 381.52 g/mol, XLogP of 4.10, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-ethylanilino)-2-oxoethyl]-N-methyl-2-(4-propylanilino)propanamide is sourced from PubChem (CID 112799196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).