N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide

C21H33N3O3 — CID 17412870

IUPACN-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CC(=O)Nc1cccc(C)c1C)CC(=O)NC1CCCCC1
InChIInChI=1S/C21H33N3O3/c1-16-8-7-11-19(17(16)2)23-21(26)15-24(12-13-27-3)14-20(25)22-18-9-5-4-6-10-18/h7-8,11,18H,4-6,9-10,12-15H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyAFJDPYGEQRXQJZ-UHFFFAOYSA-N
MW375.51 g/mol
LogP2.64
Rot. Bonds9

About N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide

N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide (PubChem CID 17412870) has the molecular formula C21H33N3O3 and a molecular weight of 375.51 g/mol. Its IUPAC name is N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide
PubChem CID17412870
Molecular FormulaC21H33N3O3
Molecular Weight375.51 g/mol
Exact Mass375.25
IUPAC NameN-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide
SMILESCOCCN(CC(=O)Nc1cccc(C)c1C)CC(=O)NC1CCCCC1
InChIInChI=1S/C21H33N3O3/c1-16-8-7-11-19(17(16)2)23-21(26)15-24(12-13-27-3)14-20(25)22-18-9-5-4-6-10-18/h7-8,11,18H,4-6,9-10,12-15H2,1-3H3,(H,22,25)(H,23,26)
InChIKeyAFJDPYGEQRXQJZ-UHFFFAOYSA-N
XLogP2.64
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.51
LogP ≤ 52.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cycloheptyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-methylamino]acetamide
CID 38510500
N-cyclooctyl-2-[[2-(2-methoxyanilino)-2-oxoethyl]-propylamino]acetamide
CID 27098874
2-(cyclohexylcarbamoylamino)-N-(2,3-dimethylphenyl)acetamide
CID 51179268
2-(cycloheptylamino)-N-(2,3-dimethylphenyl)acetamide
CID 109005556
N-(2,3-dimethylphenyl)-2-[[(2R)-3-(4-fluorophenoxy)-2-hydroxypropyl]-(2-methoxyethyl)amino]acetamide
CID 31884698
N-cyclopentyl-2-[4-[2-(2,3-dimethylanilino)-2-oxoethyl]piperazine-1,4-diium-1-yl]acetamide
CID 9118004
2-[acetyl(2-methoxyethyl)amino]-N-cyclohexylacetamide
CID 113159800
2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]-N-(2-methyl-2-morpholin-4-ylpropyl)acetamide
CID 24534478
1-N-cyclohexyl-4-N-(2,3-dimethylphenyl)cyclohexane-1,4-dicarboxamide
CID 109146152
N-cyclopentyl-3-(2,3-dimethylphenoxy)propanamide
CID 60737583
3-(cyclohexylamino)-N-(2,3-dimethylphenyl)propanamide
CID 109014195
2-[[2-(cyclopentylcarbamoylamino)-2-oxoethyl]-propylamino]-N-(2-methylphenyl)acetamide
CID 27221599

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide?
The IUPAC name of N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide (CID 17412870) is N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide.
What is the SMILES notation for N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide?
The canonical SMILES for N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide is COCCN(CC(=O)Nc1cccc(C)c1C)CC(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide?
The InChIKey is AFJDPYGEQRXQJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O3/c1-16-8-7-11-19(17(16)2)23-21(26)15-24(12-13-27-3)14-20(25)22-18-9-5-4-6-10-18/h7-8,11,18H,4-6,9-10,12-15H2,1-3H3,(H,22,25)(H,23,26).
What are the key properties of N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide?
N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide has a molecular weight of 375.51 g/mol, XLogP of 2.64, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-[[2-(2,3-dimethylanilino)-2-oxoethyl]-(2-methoxyethyl)amino]acetamide is sourced from PubChem (CID 17412870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).