4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide

C21H18ClNO2 — CID 8813273

IUPAC4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccc(OCc3ccccc3Cl)cc2)c1
InChIInChI=1S/C21H18ClNO2/c1-15-5-4-7-18(13-15)23-21(24)16-9-11-19(12-10-16)25-14-17-6-2-3-8-20(17)22/h2-13H,14H2,1H3,(H,23,24)
InChIKeyRZVLMAUFWRGCIC-UHFFFAOYSA-N
MW351.83 g/mol
LogP5.48
Rot. Bonds5

About 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide

4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide (PubChem CID 8813273) has the molecular formula C21H18ClNO2 and a molecular weight of 351.83 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
PubChem CID8813273
Molecular FormulaC21H18ClNO2
Molecular Weight351.83 g/mol
Exact Mass351.10
IUPAC Name4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide
SMILESCc1cccc(NC(=O)c2ccc(OCc3ccccc3Cl)cc2)c1
InChIInChI=1S/C21H18ClNO2/c1-15-5-4-7-18(13-15)23-21(24)16-9-11-19(12-10-16)25-14-17-6-2-3-8-20(17)22/h2-13H,14H2,1H3,(H,23,24)
InChIKeyRZVLMAUFWRGCIC-UHFFFAOYSA-N
XLogP5.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.83
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(2-chlorophenyl)methoxy]-N-(3,5-dimethylphenyl)benzamide
CID 8813300
N-(3-bromophenyl)-4-[(2-chlorophenyl)methoxy]benzamide
CID 19916424
4-[(2-chlorophenyl)methoxy]-N-phenylbenzamide
CID 8813243
N-(4-chloro-2-methylphenyl)-4-[(2-chlorophenyl)methoxy]benzamide
CID 8813256
4-[(2-chlorophenyl)methoxy]-N-(4-phenoxyphenyl)benzamide
CID 19916426
3-[(2-chlorophenyl)methoxy]-N-(3-methoxyphenyl)benzamide
CID 30155561
N-(3-methylphenyl)-4-[4-[(3-methylphenyl)carbamoyl]phenoxy]benzamide
CID 3539312
N-[4-[(2R)-butan-2-yl]phenyl]-4-[(2-chlorophenyl)methoxy]benzamide
CID 8814272
N-(3-methylphenyl)-4-phenoxybenzamide
CID 7946520
4-[(2-chlorophenyl)methoxy]-N-(5-methyl-1,3,4-thiadiazol-2-yl)benzamide
CID 8814346
N-(3-methylphenyl)-4-(2-phenylsulfanylethoxy)benzamide
CID 28571355
4-[(2-chlorophenyl)methoxy]-N-(2-methoxyethyl)benzamide
CID 6462098

Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide?
The IUPAC name of 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide (CID 8813273) is 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide.
What is the SMILES notation for 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide?
The canonical SMILES for 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide is Cc1cccc(NC(=O)c2ccc(OCc3ccccc3Cl)cc2)c1.
What is the InChIKey of 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide?
The InChIKey is RZVLMAUFWRGCIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClNO2/c1-15-5-4-7-18(13-15)23-21(24)16-9-11-19(12-10-16)25-14-17-6-2-3-8-20(17)22/h2-13H,14H2,1H3,(H,23,24).
What are the key properties of 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide?
4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide has a molecular weight of 351.83 g/mol, XLogP of 5.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methoxy]-N-(3-methylphenyl)benzamide is sourced from PubChem (CID 8813273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).