3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide

C15H13Cl2NO2 — CID 91682782

IUPAC3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide
SMILESCc1ccc(COc2c(Cl)cc(C(N)=O)cc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2/c1-9-2-4-10(5-3-9)8-20-14-12(16)6-11(15(18)19)7-13(14)17/h2-7H,8H2,1H3,(H2,18,19)
InChIKeyWYXKVHJOLAVBBK-UHFFFAOYSA-N
MW310.18 g/mol
LogP3.98
Rot. Bonds4

About 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide

3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide (PubChem CID 91682782) has the molecular formula C15H13Cl2NO2 and a molecular weight of 310.18 g/mol. Its IUPAC name is 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide.

Molecular Properties

Compound Name3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide
PubChem CID91682782
Molecular FormulaC15H13Cl2NO2
Molecular Weight310.18 g/mol
Exact Mass309.03
IUPAC Name3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide
SMILESCc1ccc(COc2c(Cl)cc(C(N)=O)cc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2/c1-9-2-4-10(5-3-9)8-20-14-12(16)6-11(15(18)19)7-13(14)17/h2-7H,8H2,1H3,(H2,18,19)
InChIKeyWYXKVHJOLAVBBK-UHFFFAOYSA-N
XLogP3.98
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.18
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3,5-dichloro-4-[(2-methylphenyl)methoxy]benzamide
CID 91682780
(E)-3-[3,5-dichloro-4-[(4-methylphenyl)methoxy]phenyl]prop-2-enoic acid
CID 6283710
4-[(5,7-dichloro-2-methylquinolin-8-yl)oxymethyl]benzamide
CID 27311006
3,5-dimethyl-4-phenylmethoxybenzamide
CID 97179397
3,5-dichloro-4-[(2-fluorophenyl)methoxy]benzamide
CID 91682781
3-[(4-amino-2,6-dichlorophenoxy)methyl]benzamide
CID 43351625
3,5-dichloro-4-phenylmethoxybenzoyl chloride
CID 11255525
2-chloro-N-[(Z)-[3,5-dichloro-4-[(4-methylphenyl)methoxy]phenyl]methylideneamino]-4-methylbenzamide
CID 126061899
[3,5-dichloro-4-[(4-methylphenyl)methoxy]phenyl]-(4-methylpiperidin-1-yl)methanethione
CID 3957639
3-chloro-N-(3,4-dichlorophenyl)-5-methoxy-4-[(4-methylphenyl)methoxy]benzamide
CID 3447717
4-[[2,6-dichloro-4-[(E)-2-cyano-2-(4-methylphenyl)ethenyl]phenoxy]methyl]benzoic acid
CID 21374957
4-[(4-chlorophenyl)methoxy]-3-ethoxy-5-iodobenzamide
CID 91682374

Frequently Asked Questions

What is the IUPAC name of 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide?
The IUPAC name of 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide (CID 91682782) is 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide.
What is the SMILES notation for 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide?
The canonical SMILES for 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide is Cc1ccc(COc2c(Cl)cc(C(N)=O)cc2Cl)cc1.
What is the InChIKey of 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide?
The InChIKey is WYXKVHJOLAVBBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2/c1-9-2-4-10(5-3-9)8-20-14-12(16)6-11(15(18)19)7-13(14)17/h2-7H,8H2,1H3,(H2,18,19).
What are the key properties of 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide?
3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide has a molecular weight of 310.18 g/mol, XLogP of 3.98, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dichloro-4-[(4-methylphenyl)methoxy]benzamide is sourced from PubChem (CID 91682782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).