4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide

C22H23NO3S — CID 8891705

IUPAC4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
SMILESCOCc1ccc(C(=O)N(Cc2cccs2)Cc2ccccc2OC)cc1
InChIInChI=1S/C22H23NO3S/c1-25-16-17-9-11-18(12-10-17)22(24)23(15-20-7-5-13-27-20)14-19-6-3-4-8-21(19)26-2/h3-13H,14-16H2,1-2H3
InChIKeyKLJNVNKMXYCRJM-UHFFFAOYSA-N
MW381.50 g/mol
LogP4.75
Rot. Bonds8

About 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide

4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 8891705) has the molecular formula C22H23NO3S and a molecular weight of 381.50 g/mol. Its IUPAC name is 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
PubChem CID8891705
Molecular FormulaC22H23NO3S
Molecular Weight381.50 g/mol
Exact Mass381.14
IUPAC Name4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
SMILESCOCc1ccc(C(=O)N(Cc2cccs2)Cc2ccccc2OC)cc1
InChIInChI=1S/C22H23NO3S/c1-25-16-17-9-11-18(12-10-17)22(24)23(15-20-7-5-13-27-20)14-19-6-3-4-8-21(19)26-2/h3-13H,14-16H2,1-2H3
InChIKeyKLJNVNKMXYCRJM-UHFFFAOYSA-N
XLogP4.75
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.50
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

3,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 8700024
N-[(2-methoxyphenyl)methyl]-6-methyl-N-(thiophen-2-ylmethyl)pyridine-3-carboxamide
CID 31119902
4-(2,5-dioxopyrrolidin-1-yl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 31511205
2-hydroxy-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 112795014
N-[(2-methoxyphenyl)methyl]-3-methylsulfonyl-N-(thiophen-2-ylmethyl)benzamide
CID 55333106
2-amino-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)acetamide
CID 119268849
3-amino-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)propanamide
CID 119268847
N-[(2-methoxyphenyl)methyl]-2-(methylamino)-N-(thiophen-2-ylmethyl)acetamide
CID 119685026
2-ethyl-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)butanamide
CID 112795027
3-(diethylsulfamoyl)-4-fluoro-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide
CID 55332989
N-[(2-methoxyphenyl)methyl]-5-methyl-N-(thiophen-2-ylmethyl)pyrazine-2-carboxamide
CID 26905550
N-[(2-methoxyphenyl)methyl]-5-methyl-N-(thiophen-2-ylmethyl)-1,3-oxazole-4-carboxamide
CID 47074235

Frequently Asked Questions

What is the IUPAC name of 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide (CID 8891705) is 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide is COCc1ccc(C(=O)N(Cc2cccs2)Cc2ccccc2OC)cc1.
What is the InChIKey of 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is KLJNVNKMXYCRJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO3S/c1-25-16-17-9-11-18(12-10-17)22(24)23(15-20-7-5-13-27-20)14-19-6-3-4-8-21(19)26-2/h3-13H,14-16H2,1-2H3.
What are the key properties of 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide?
4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 381.50 g/mol, XLogP of 4.75, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(methoxymethyl)-N-[(2-methoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 8891705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).