2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide

C18H18Cl2N2O2 — CID 51164454

IUPAC2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)CNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H18Cl2N2O2/c1-11-5-3-4-6-14(11)12(2)22-17(23)10-21-18(24)15-8-7-13(19)9-16(15)20/h3-9,12H,10H2,1-2H3,(H,21,24)(H,22,23)
InChIKeySWNFEHVAYPFDGW-UHFFFAOYSA-N
MW365.26 g/mol
LogP3.91
Rot. Bonds5

About 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide

2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide (PubChem CID 51164454) has the molecular formula C18H18Cl2N2O2 and a molecular weight of 365.26 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
PubChem CID51164454
Molecular FormulaC18H18Cl2N2O2
Molecular Weight365.26 g/mol
Exact Mass364.07
IUPAC Name2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide
SMILESCc1ccccc1C(C)NC(=O)CNC(=O)c1ccc(Cl)cc1Cl
InChIInChI=1S/C18H18Cl2N2O2/c1-11-5-3-4-6-14(11)12(2)22-17(23)10-21-18(24)15-8-7-13(19)9-16(15)20/h3-9,12H,10H2,1-2H3,(H,21,24)(H,22,23)
InChIKeySWNFEHVAYPFDGW-UHFFFAOYSA-N
XLogP3.91
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.26
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide (CID 51164454) is 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide is Cc1ccccc1C(C)NC(=O)CNC(=O)c1ccc(Cl)cc1Cl.
What is the InChIKey of 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide?
The InChIKey is SWNFEHVAYPFDGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18Cl2N2O2/c1-11-5-3-4-6-14(11)12(2)22-17(23)10-21-18(24)15-8-7-13(19)9-16(15)20/h3-9,12H,10H2,1-2H3,(H,21,24)(H,22,23).
What are the key properties of 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide?
2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide has a molecular weight of 365.26 g/mol, XLogP of 3.91, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-[1-(2-methylphenyl)ethylamino]-2-oxoethyl]benzamide is sourced from PubChem (CID 51164454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).