N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide

C20H23Cl2N3O2 — CID 26599527

IUPACN-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)Nc1ccc(Cl)cc1Cl)CC(=O)N(C)c1ccccc1
InChIInChI=1S/C20H23Cl2N3O2/c1-3-11-25(14-20(27)24(2)16-7-5-4-6-8-16)13-19(26)23-18-10-9-15(21)12-17(18)22/h4-10,12H,3,11,13-14H2,1-2H3,(H,23,26)
InChIKeyOMCABHHHOIWDCF-UHFFFAOYSA-N
MW408.33 g/mol
LogP4.31
Rot. Bonds8

About N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide

N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide (PubChem CID 26599527) has the molecular formula C20H23Cl2N3O2 and a molecular weight of 408.33 g/mol. Its IUPAC name is N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide.

Molecular Properties

Compound NameN-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide
PubChem CID26599527
Molecular FormulaC20H23Cl2N3O2
Molecular Weight408.33 g/mol
Exact Mass407.12
IUPAC NameN-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide
SMILESCCCN(CC(=O)Nc1ccc(Cl)cc1Cl)CC(=O)N(C)c1ccccc1
InChIInChI=1S/C20H23Cl2N3O2/c1-3-11-25(14-20(27)24(2)16-7-5-4-6-8-16)13-19(26)23-18-10-9-15(21)12-17(18)22/h4-10,12H,3,11,13-14H2,1-2H3,(H,23,26)
InChIKeyOMCABHHHOIWDCF-UHFFFAOYSA-N
XLogP4.31
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500408.33
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[2-(2-bromoanilino)-2-oxoethyl]-propylamino]-N-(2,4-dichlorophenyl)acetamide
CID 27246768
N-(2,4-dichlorophenyl)-2-[[2-oxo-2-(1-phenylethylamino)ethyl]-propylamino]acetamide
CID 55354113
2-[[2-[cyclopropylmethyl(methyl)amino]-2-oxoethyl]-propylamino]-N-(2,4-dichlorophenyl)acetamide
CID 60502016
4-[[2-(2,4-dichloroanilino)-2-oxoethyl]-propylamino]butanoic acid
CID 119134576
2-[[2-(2,4-dichloroanilino)-2-oxoethyl]-propylamino]-N-(3,4-difluorophenyl)acetamide
CID 4968627
2-(dibutylamino)-N-(2,4-dichlorophenyl)acetamide
CID 18870877
N-(2,4-dichlorophenyl)-3-(N-ethylanilino)propanamide
CID 109036579
2-[[2-(3-cyanoanilino)-2-oxoethyl]-propylamino]-N-(2,4-dichlorophenyl)acetamide
CID 27246695
2-[butyl(ethyl)amino]-N-(2,4-dichlorophenyl)acetamide
CID 78821204
2-[[2-(2,4-dichloroanilino)-2-oxoethyl]-propylamino]-N-(2,4-dimethoxyphenyl)acetamide
CID 2658488
2-[[2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl]-propylamino]-N-(2,4-dichlorophenyl)acetamide
CID 27246805
2-[bis(2-hydroxyethyl)amino]-N-(2,4-dichlorophenyl)acetamide
CID 18870879

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The IUPAC name of N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide (CID 26599527) is N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide.
What is the SMILES notation for N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The canonical SMILES for N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide is CCCN(CC(=O)Nc1ccc(Cl)cc1Cl)CC(=O)N(C)c1ccccc1.
What is the InChIKey of N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide?
The InChIKey is OMCABHHHOIWDCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23Cl2N3O2/c1-3-11-25(14-20(27)24(2)16-7-5-4-6-8-16)13-19(26)23-18-10-9-15(21)12-17(18)22/h4-10,12H,3,11,13-14H2,1-2H3,(H,23,26).
What are the key properties of N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide?
N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide has a molecular weight of 408.33 g/mol, XLogP of 4.31, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dichlorophenyl)-2-[[2-(N-methylanilino)-2-oxoethyl]-propylamino]acetamide is sourced from PubChem (CID 26599527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).