2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide

C17H17Cl2NO3 — CID 90623355

IUPAC2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
SMILESCOc1cccc(C(CNC(=O)c2ccc(Cl)cc2Cl)OC)c1
InChIInChI=1S/C17H17Cl2NO3/c1-22-13-5-3-4-11(8-13)16(23-2)10-20-17(21)14-7-6-12(18)9-15(14)19/h3-9,16H,10H2,1-2H3,(H,20,21)
InChIKeyBDTRFDIMBLGHDX-UHFFFAOYSA-N
MW354.23 g/mol
LogP4.12
Rot. Bonds6

About 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide

2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide (PubChem CID 90623355) has the molecular formula C17H17Cl2NO3 and a molecular weight of 354.23 g/mol. Its IUPAC name is 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
PubChem CID90623355
Molecular FormulaC17H17Cl2NO3
Molecular Weight354.23 g/mol
Exact Mass353.06
IUPAC Name2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
SMILESCOc1cccc(C(CNC(=O)c2ccc(Cl)cc2Cl)OC)c1
InChIInChI=1S/C17H17Cl2NO3/c1-22-13-5-3-4-11(8-13)16(23-2)10-20-17(21)14-7-6-12(18)9-15(14)19/h3-9,16H,10H2,1-2H3,(H,20,21)
InChIKeyBDTRFDIMBLGHDX-UHFFFAOYSA-N
XLogP4.12
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.23
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-2-chloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
CID 90623399
2,5-dichloro-N-[2-(3-fluorophenyl)-2-methoxyethyl]benzamide
CID 90622974
N-[(2S)-2-(3-chlorophenyl)-2-methoxyethyl]-3-fluoropyridine-4-carboxamide
CID 124607627
1-(5-chloro-2-methoxyphenyl)-3-[2-methoxy-2-(3-methoxyphenyl)ethyl]urea
CID 90623652
2,4-dichloro-N-[2-methoxy-2-(2-methylphenyl)ethyl]benzamide
CID 90598769
N'-(3-chloro-4-fluorophenyl)-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]oxamide
CID 90623593
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-5-methyl-1,2-oxazole-4-carboxamide
CID 73168524
N-[(2R)-2-(3-chlorophenyl)-2-methoxyethyl]-3-hydroxypyridine-4-carboxamide
CID 97320910
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-3-methylbenzamide
CID 90623269
N-[2-methoxy-2-(3-methoxyphenyl)ethyl]-2-methyl-3-nitrobenzamide
CID 90623331
4-ethyl-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide
CID 90623280
2-chloro-N-[2-(dimethylamino)-2-(3-methoxyphenyl)ethyl]benzamide
CID 45001535

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide?
The IUPAC name of 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide (CID 90623355) is 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide.
What is the SMILES notation for 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide?
The canonical SMILES for 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide is COc1cccc(C(CNC(=O)c2ccc(Cl)cc2Cl)OC)c1.
What is the InChIKey of 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide?
The InChIKey is BDTRFDIMBLGHDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17Cl2NO3/c1-22-13-5-3-4-11(8-13)16(23-2)10-20-17(21)14-7-6-12(18)9-15(14)19/h3-9,16H,10H2,1-2H3,(H,20,21).
What are the key properties of 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide?
2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide has a molecular weight of 354.23 g/mol, XLogP of 4.12, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-N-[2-methoxy-2-(3-methoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 90623355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).