N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide

C81H98Cl4N8O9 — CID 161240938

IUPACN-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide
SMILESCc1cc(NC(=O)c2c(C)cccc2OCCN(C)C)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCCCC2)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCOCC2)ccc1Cl.Cc1ccc(OCCN(C)C)c(C(=O)Nc2ccc(Cl)c(C)c2)c1
InChIInChI=1S/C22H27ClN2O2.C21H25ClN2O3.2C19H23ClN2O2/c1-16-7-6-8-20(27-14-13-25-11-4-3-5-12-25)21(16)22(26)24-18-9-10-19(23)17(2)15-18;1-15-4-3-5-19(27-13-10-24-8-11-26-12-9-24)20(15)21(25)23-17-6-7-18(22)16(2)14-17;1-13-5-8-18(24-10-9-22(3)4)16(11-13)19(23)21-15-6-7-17(20)14(2)12-15;1-13-6-5-7-17(24-11-10-22(3)4)18(13)19(23)21-15-8-9-16(20)14(2)12-15/h6-10,15H,3-5,11-14H2,1-2H3,(H,24,26);3-7,14H,8-13H2,1-2H3,(H,23,25);5-8,11-12H,9-10H2,1-4H3,(H,21,23);5-9,12H,10-11H2,1-4H3,(H,21,23)
InChIKeyUZZJISYLJMCBPK-UHFFFAOYSA-N
MW1469.53 g/mol
LogP17.29
Rot. Bonds24

About N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide

N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide (PubChem CID 161240938) has the molecular formula C81H98Cl4N8O9 and a molecular weight of 1469.53 g/mol. Its IUPAC name is N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide.

Molecular Properties

Compound NameN-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide
PubChem CID161240938
Molecular FormulaC81H98Cl4N8O9
Molecular Weight1469.53 g/mol
Exact Mass1466.62
IUPAC NameN-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide
SMILESCc1cc(NC(=O)c2c(C)cccc2OCCN(C)C)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCCCC2)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCOCC2)ccc1Cl.Cc1ccc(OCCN(C)C)c(C(=O)Nc2ccc(Cl)c(C)c2)c1
InChIInChI=1S/C22H27ClN2O2.C21H25ClN2O3.2C19H23ClN2O2/c1-16-7-6-8-20(27-14-13-25-11-4-3-5-12-25)21(16)22(26)24-18-9-10-19(23)17(2)15-18;1-15-4-3-5-19(27-13-10-24-8-11-26-12-9-24)20(15)21(25)23-17-6-7-18(22)16(2)14-17;1-13-5-8-18(24-10-9-22(3)4)16(11-13)19(23)21-15-6-7-17(20)14(2)12-15;1-13-6-5-7-17(24-11-10-22(3)4)18(13)19(23)21-15-8-9-16(20)14(2)12-15/h6-10,15H,3-5,11-14H2,1-2H3,(H,24,26);3-7,14H,8-13H2,1-2H3,(H,23,25);5-8,11-12H,9-10H2,1-4H3,(H,21,23);5-9,12H,10-11H2,1-4H3,(H,21,23)
InChIKeyUZZJISYLJMCBPK-UHFFFAOYSA-N
XLogP17.29
TPSA175.51 Ų
H-Bond Donors4
H-Bond Acceptors13
Rotatable Bonds24
Heavy Atoms102
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001469.53
LogP ≤ 517.29
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1013

Analyze N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide with MolForge

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Related Compounds

N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide
CID 134195679
4-chloro-N-[[2-[2-(dimethylamino)ethoxy]-6-methylphenyl]methyl]-3-methylaniline;N-(4-chloro-3-methylphenyl)-2-[3-(diethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide
CID 157398930
N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(diethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(3-methylbutoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide
CID 158301434
N-(4-chloro-3-methylphenyl)-2-[2-(diethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[3-(dimethylamino)propoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-[2-(4-methylpiperazin-1-yl)ethoxy]benzamide;2-[2-(dimethylamino)ethoxy]-6-ethoxy-N-[[4-methyl-3-(trifluoromethyl)phenyl]methyl]benzamide
CID 157101806
N-[4-chloro-3-(trifluoromethyl)phenyl]-2-[3-(dimethylamino)propoxy]-6-methylbenzamide
CID 129087176
2-[2-(dimethylamino)ethoxy]-N-(3-methylphenyl)benzamide
CID 86991936
4-[2-(2,3-dichlorophenoxy)ethyl]morpholine
CID 869488
N-(4-chloro-3-methylphenyl)-4-[2-(dimethylamino)ethoxy]-6-ethoxypyrimidine-5-carboxamide
CID 129087164
2-(2-aminoethoxy)-5-chloro-N-(2-chloro-4-methylphenyl)benzamide;5-chloro-N-(2-chloro-4-methylphenyl)-2-(2-morpholin-4-ylethoxy)benzamide;tetrakis(5-chloro-N-(2-chloro-4-methylphenyl)-2-piperidin-4-yloxybenzamide)
CID 158264393
1-[4-methyl-3-(2-morpholin-4-ylethoxy)phenyl]-3-phenylurea
CID 90894366
N-[3-chloro-4-[2-(dimethylamino)ethoxy]phenyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 166208969
5-chloro-N-(2-chloro-4-methylphenyl)-2-(2-piperazin-1-ylethoxy)benzamide
CID 118583135

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide?
The IUPAC name of N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide (CID 161240938) is N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide.
What is the SMILES notation for N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide?
The canonical SMILES for N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide is Cc1cc(NC(=O)c2c(C)cccc2OCCN(C)C)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCCCC2)ccc1Cl.Cc1cc(NC(=O)c2c(C)cccc2OCCN2CCOCC2)ccc1Cl.Cc1ccc(OCCN(C)C)c(C(=O)Nc2ccc(Cl)c(C)c2)c1.
What is the InChIKey of N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide?
The InChIKey is UZZJISYLJMCBPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27ClN2O2.C21H25ClN2O3.2C19H23ClN2O2/c1-16-7-6-8-20(27-14-13-25-11-4-3-5-12-25)21(16)22(26)24-18-9-10-19(23)17(2)15-18;1-15-4-3-5-19(27-13-10-24-8-11-26-12-9-24)20(15)21(25)23-17-6-7-18(22)16(2)14-17;1-13-5-8-18(24-10-9-22(3)4)16(11-13)19(23)21-15-6-7-17(20)14(2)12-15;1-13-6-5-7-17(24-11-10-22(3)4)18(13)19(23)21-15-8-9-16(20)14(2)12-15/h6-10,15H,3-5,11-14H2,1-2H3,(H,24,26);3-7,14H,8-13H2,1-2H3,(H,23,25);5-8,11-12H,9-10H2,1-4H3,(H,21,23);5-9,12H,10-11H2,1-4H3,(H,21,23).
What are the key properties of N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide?
N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide has a molecular weight of 1469.53 g/mol, XLogP of 17.29, 24 rotatable bonds, 4 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-5-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-[2-(dimethylamino)ethoxy]-6-methylbenzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-morpholin-4-ylethoxy)benzamide;N-(4-chloro-3-methylphenyl)-2-methyl-6-(2-piperidin-1-ylethoxy)benzamide is sourced from PubChem (CID 161240938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).