3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide

C22H21NO4 — CID 2791610

IUPAC3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C22H21NO4/c1-25-20-12-17(13-21(14-20)26-2)22(24)23-18-8-10-19(11-9-18)27-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyTZAODTSPIGJAHF-UHFFFAOYSA-N
MW363.41 g/mol
LogP4.54
Rot. Bonds7

About 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide

3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide (PubChem CID 2791610) has the molecular formula C22H21NO4 and a molecular weight of 363.41 g/mol. Its IUPAC name is 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide.

Molecular Properties

Compound Name3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
PubChem CID2791610
Molecular FormulaC22H21NO4
Molecular Weight363.41 g/mol
Exact Mass363.15
IUPAC Name3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide
SMILESCOc1cc(OC)cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c1
InChIInChI=1S/C22H21NO4/c1-25-20-12-17(13-21(14-20)26-2)22(24)23-18-8-10-19(11-9-18)27-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3,(H,23,24)
InChIKeyTZAODTSPIGJAHF-UHFFFAOYSA-N
XLogP4.54
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.41
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dimethoxy-4-phenylmethoxy-N-(4-phenylmethoxyphenyl)benzamide
CID 139779676
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] 3,5-dimethoxybenzoate
CID 7727286
3,5-dimethoxy-N-[4-(2-phenylethylamino)phenyl]benzamide
CID 112983238
[3-[(4-phenylmethoxyphenyl)carbamoyl]phenyl] acetate
CID 2995401
3-methoxy-N-(3-phenylmethoxyphenyl)benzamide
CID 135564193
4-cyano-N-(4-phenylmethoxyphenyl)benzamide
CID 40610982
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
N-[4-(2-methylpropoxy)phenyl]-3-phenylmethoxybenzamide
CID 17148534
methyl 3-oxo-3-(4-phenylmethoxyanilino)propanoate
CID 28638020
N-[4-(2-methylpropoxy)phenyl]-4-phenylmethoxybenzamide
CID 4958406
3-iodo-N-(4-phenylmethoxyphenyl)benzamide
CID 3409101
N-(4-methoxyphenyl)-3-(naphthalen-2-yloxymethyl)benzamide
CID 1310649

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide?
The IUPAC name of 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide (CID 2791610) is 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide.
What is the SMILES notation for 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide?
The canonical SMILES for 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide is COc1cc(OC)cc(C(=O)Nc2ccc(OCc3ccccc3)cc2)c1.
What is the InChIKey of 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide?
The InChIKey is TZAODTSPIGJAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21NO4/c1-25-20-12-17(13-21(14-20)26-2)22(24)23-18-8-10-19(11-9-18)27-15-16-6-4-3-5-7-16/h3-14H,15H2,1-2H3,(H,23,24).
What are the key properties of 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide?
3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide has a molecular weight of 363.41 g/mol, XLogP of 4.54, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethoxy-N-(4-phenylmethoxyphenyl)benzamide is sourced from PubChem (CID 2791610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).