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)

C112H118Cl12N12O13 — CID 158264393

IUPAC2-(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)
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN2CCOCC2)c(Cl)c1
InChIInChI=1S/C20H22Cl2N2O3.4C19H20Cl2N2O2.C16H16Cl2N2O2/c1-14-2-4-18(17(22)12-14)23-20(25)16-13-15(21)3-5-19(16)27-11-8-24-6-9-26-10-7-24;4*1-12-2-4-17(16(21)10-12)23-19(24)15-11-13(20)3-5-18(15)25-14-6-8-22-9-7-14;1-10-2-4-14(13(18)8-10)20-16(21)12-9-11(17)3-5-15(12)22-7-6-19/h2-5,12-13H,6-11H2,1H3,(H,23,25);4*2-5,10-11,14,22H,6-9H2,1H3,(H,23,24);2-5,8-9H,6-7,19H2,1H3,(H,20,21)
InChIKeyGIGHFQTVFMLTDG-UHFFFAOYSA-N
MW2265.68 g/mol
LogP26.90
Rot. Bonds27

About 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)

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) (PubChem CID 158264393) has the molecular formula C112H118Cl12N12O13 and a molecular weight of 2265.68 g/mol. Its IUPAC name is 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).

Molecular Properties

Compound Name2-(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)
PubChem CID158264393
Molecular FormulaC112H118Cl12N12O13
Molecular Weight2265.68 g/mol
Exact Mass2258.52
IUPAC Name2-(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)
SMILESCc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN2CCOCC2)c(Cl)c1
InChIInChI=1S/C20H22Cl2N2O3.4C19H20Cl2N2O2.C16H16Cl2N2O2/c1-14-2-4-18(17(22)12-14)23-20(25)16-13-15(21)3-5-19(16)27-11-8-24-6-9-26-10-7-24;4*1-12-2-4-17(16(21)10-12)23-19(24)15-11-13(20)3-5-18(15)25-14-6-8-22-9-7-14;1-10-2-4-14(13(18)8-10)20-16(21)12-9-11(17)3-5-15(12)22-7-6-19/h2-5,12-13H,6-11H2,1H3,(H,23,25);4*2-5,10-11,14,22H,6-9H2,1H3,(H,23,24);2-5,8-9H,6-7,19H2,1H3,(H,20,21)
InChIKeyGIGHFQTVFMLTDG-UHFFFAOYSA-N
XLogP26.90
TPSA316.59 Ų
H-Bond Donors11
H-Bond Acceptors19
Rotatable Bonds27
Heavy Atoms149
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002265.68
LogP ≤ 526.90
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1019

Analyze 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) with MolForge

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Related Compounds

5-chloro-N-(2-chloro-4-methylphenyl)-2-(2-piperazin-1-ylethoxy)benzamide
CID 118583135
5-chloro-N-(2-chloro-4-nitrophenyl)-2-(2-morpholin-4-ylethoxy)benzamide
CID 71527591
N-(4-amino-2-chlorophenyl)-5-chloro-2-(2-piperidin-4-ylethoxy)benzamide
CID 77106978
5-chloro-N-(2-piperazin-1-ylethyl)-2-propoxybenzamide
CID 119445271
N-(2,4-dichlorophenyl)-4-(2-morpholin-4-ylethyl)piperazine-1-carboxamide
CID 113105994
2-amino-5-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967454
5-chloro-2-cyclopentyloxy-N-piperidin-3-ylbenzamide;hydrochloride
CID 119428659
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
5-bromo-N-(2,4-dichlorophenyl)-2-propoxybenzamide
CID 17351367
2,4-dichloro-N-[4-chloro-2-(2-morpholin-4-ylethylcarbamoyl)phenyl]benzamide
CID 991469
5-chloro-N-piperidin-3-yl-2-propoxybenzamide;hydrochloride
CID 119424718
2-[[5-chloro-2-(2-morpholin-4-ylethoxy)phenyl]methoxy]-N-pyridin-3-ylbenzamide
CID 118911706

Frequently Asked Questions

What is the IUPAC name of 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)?
The IUPAC name of 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) is 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).
What is the SMILES notation for 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)?
The canonical SMILES for 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) is Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OC2CCNCC2)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN)c(Cl)c1.Cc1ccc(NC(=O)c2cc(Cl)ccc2OCCN2CCOCC2)c(Cl)c1.
What is the InChIKey of 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)?
The InChIKey is GIGHFQTVFMLTDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22Cl2N2O3.4C19H20Cl2N2O2.C16H16Cl2N2O2/c1-14-2-4-18(17(22)12-14)23-20(25)16-13-15(21)3-5-19(16)27-11-8-24-6-9-26-10-7-24;4*1-12-2-4-17(16(21)10-12)23-19(24)15-11-13(20)3-5-18(15)25-14-6-8-22-9-7-14;1-10-2-4-14(13(18)8-10)20-16(21)12-9-11(17)3-5-15(12)22-7-6-19/h2-5,12-13H,6-11H2,1H3,(H,23,25);4*2-5,10-11,14,22H,6-9H2,1H3,(H,23,24);2-5,8-9H,6-7,19H2,1H3,(H,20,21).
What are the key properties of 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)?
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) has a molecular weight of 2265.68 g/mol, XLogP of 26.90, 27 rotatable bonds, 11 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 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) is sourced from PubChem (CID 158264393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).