4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide

C18H18Cl2N2O2 — CID 4570417

IUPAC4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide
SMILESCCN(CCNC(=O)c1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-2-22(18(24)14-5-9-16(20)10-6-14)12-11-21-17(23)13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H,21,23)
InChIKeyMAPBHUFPYCIWOT-UHFFFAOYSA-N
MW365.26 g/mol
LogP3.89
Rot. Bonds6

About 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide

4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide (PubChem CID 4570417) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide.

Molecular Properties

Compound Name4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide
PubChem CID4570417
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC Name4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide
SMILESCCN(CCNC(=O)c1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1
InChIInChI=1S/C18H18Cl2N2O2/c1-2-22(18(24)14-5-9-16(20)10-6-14)12-11-21-17(23)13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H,21,23)
InChIKeyMAPBHUFPYCIWOT-UHFFFAOYSA-N
XLogP3.89
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-chloro-N-ethyl-N-octylbenzamide
CID 91716392
N-[2-[(4-chlorobenzoyl)amino]ethyl]-4-ethylbenzamide
CID 134039912
N-[2-[acetyl-[(4-chlorophenyl)methyl]amino]ethyl]-4-methoxybenzamide
CID 113054840
4-chloro-N-[8-[(4-chlorobenzoyl)amino]octyl]benzamide
CID 3606775
4-[[4-(diethylcarbamoyl)benzoyl]amino]butanoic acid
CID 119352901
4-[(4-chlorobenzoyl)carbamothioylamino]-N,N-diethylbenzamide
CID 17197077
4-chloro-N-(2-methoxyethyl)benzamide
CID 3457742
4-tert-butyl-N-[2-(diethylamino)ethyl]benzamide
CID 19165344
2-[(4-chlorobenzoyl)amino]ethylcarbamic acid
CID 19741762
1-N-butyl-4-N-[2-(4-chlorophenyl)ethyl]benzene-1,4-dicarboxamide
CID 109043698
N-[2-(N-acetyl-4-ethylanilino)ethyl]-4-chlorobenzamide
CID 113058431
N-[2-(diethylamino)ethyl]-4-(dimethylamino)benzamide
CID 47101000

Frequently Asked Questions

What is the IUPAC name of 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide?
The IUPAC name of 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide (CID 4570417) is 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide.
What is the SMILES notation for 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide?
The canonical SMILES for 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide is CCN(CCNC(=O)c1ccc(Cl)cc1)C(=O)c1ccc(Cl)cc1.
What is the InChIKey of 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide?
The InChIKey is MAPBHUFPYCIWOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-2-22(18(24)14-5-9-16(20)10-6-14)12-11-21-17(23)13-3-7-15(19)8-4-13/h3-10H,2,11-12H2,1H3,(H,21,23).
What are the key properties of 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide?
4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide has a molecular weight of 365.26 g/mol, XLogP of 3.89, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-N-[2-[(4-chlorobenzoyl)-ethylamino]ethyl]benzamide is sourced from PubChem (CID 4570417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).