2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide

C16H15Cl2NO2 — CID 112766523

IUPAC2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccccc1CCNC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-21-14-8-3-2-5-11(14)9-10-19-16(20)15-12(17)6-4-7-13(15)18/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyDBTFWACHKWZTQD-UHFFFAOYSA-N
MW324.21 g/mol
LogP3.97
Rot. Bonds5

About 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide

2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide (PubChem CID 112766523) has the molecular formula C16H15Cl2NO2 and a molecular weight of 324.21 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide
PubChem CID112766523
Molecular FormulaC16H15Cl2NO2
Molecular Weight324.21 g/mol
Exact Mass323.05
IUPAC Name2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide
SMILESCOc1ccccc1CCNC(=O)c1c(Cl)cccc1Cl
InChIInChI=1S/C16H15Cl2NO2/c1-21-14-8-3-2-5-11(14)9-10-19-16(20)15-12(17)6-4-7-13(15)18/h2-8H,9-10H2,1H3,(H,19,20)
InChIKeyDBTFWACHKWZTQD-UHFFFAOYSA-N
XLogP3.97
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.21
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,6-dichlorophenyl)-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 8911210
5-chloro-N-[2-(2-methoxyphenyl)ethyl]thiophene-2-carboxamide
CID 17173387
2-chloro-6-[2-(2-methoxyphenyl)ethylamino]benzoic acid
CID 106262540
2-(2,6-dichlorophenyl)sulfanyl-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 112766497
4-chloro-N-[2-(2-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 103867838
2-amino-6-chloro-N-[(2-methoxyphenyl)methyl]benzamide
CID 63660526
N-[2-[(2-chloro-6-fluorobenzoyl)amino]ethyl]-2,6-dimethoxybenzamide
CID 108538805
1-[2-(2-chlorophenyl)ethyl]-3-[(2-methoxyphenyl)methyl]urea
CID 108897450
2-[(2-chlorophenyl)methylamino]-N-[2-(2-methoxyphenyl)ethyl]acetamide
CID 108997926
N-[2-(2-methoxyphenyl)ethyl]-4-methylbenzamide
CID 8911194
N-[2-(2-methoxyphenyl)ethyl]-2,3-dimethylbenzamide
CID 26778040
N'-(2-methoxyethyl)-N-[2-(2-methoxyphenyl)ethyl]oxamide
CID 44996618

Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide (CID 112766523) is 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide is COc1ccccc1CCNC(=O)c1c(Cl)cccc1Cl.
What is the InChIKey of 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide?
The InChIKey is DBTFWACHKWZTQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15Cl2NO2/c1-21-14-8-3-2-5-11(14)9-10-19-16(20)15-12(17)6-4-7-13(15)18/h2-8H,9-10H2,1H3,(H,19,20).
What are the key properties of 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide?
2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide has a molecular weight of 324.21 g/mol, XLogP of 3.97, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-(2-methoxyphenyl)ethyl]benzamide is sourced from PubChem (CID 112766523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).