N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide

C20H20N2O4S — CID 78816507

IUPACN-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2OCc2cscn2)cc1OC
InChIInChI=1S/C20H20N2O4S/c1-3-25-18-9-8-14(10-19(18)24-2)22-20(23)16-6-4-5-7-17(16)26-11-15-12-27-13-21-15/h4-10,12-13H,3,11H2,1-2H3,(H,22,23)
InChIKeyTXUKJKACEYFFIY-UHFFFAOYSA-N
MW384.46 g/mol
LogP4.38
Rot. Bonds8

About N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide

N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide (PubChem CID 78816507) has the molecular formula C20H20N2O4S and a molecular weight of 384.46 g/mol. Its IUPAC name is N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
PubChem CID78816507
Molecular FormulaC20H20N2O4S
Molecular Weight384.46 g/mol
Exact Mass384.11
IUPAC NameN-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
SMILESCCOc1ccc(NC(=O)c2ccccc2OCc2cscn2)cc1OC
InChIInChI=1S/C20H20N2O4S/c1-3-25-18-9-8-14(10-19(18)24-2)22-20(23)16-6-4-5-7-17(16)26-11-15-12-27-13-21-15/h4-10,12-13H,3,11H2,1-2H3,(H,22,23)
InChIKeyTXUKJKACEYFFIY-UHFFFAOYSA-N
XLogP4.38
TPSA69.68 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.46
LogP ≤ 54.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-fluorophenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
CID 86907828
N-[4-(2-methoxyethoxy)phenyl]-2-(1,3-thiazol-4-ylmethoxy)benzamide
CID 86981514
N-[2-[(4-chlorophenyl)carbamoyl]phenyl]-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55583240
N-(2,2-dimethyl-1,3-benzodioxol-5-yl)-2-(1,3-thiazol-4-ylmethoxy)benzamide
CID 87004703
N-(4-amino-3-methoxyphenyl)-2-ethoxybenzamide
CID 61239481
3-methoxy-N-[3-(2-methoxyethoxy)phenyl]-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55878725
N-(4-iodophenyl)-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55577321
N-(3-iodophenyl)-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55585441
N-[6-(diethylamino)-3-pyridinyl]-3-methoxy-4-(1,3-thiazol-4-ylmethoxy)benzamide
CID 55784199
N-(4-ethoxy-3-methoxyphenyl)-2,4,5-trimethoxybenzamide
CID 9103295
N-(3-amino-4-ethoxyphenyl)-2-methoxybenzamide
CID 70635969
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide?
The IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide (CID 78816507) is N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide.
What is the SMILES notation for N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide?
The canonical SMILES for N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide is CCOc1ccc(NC(=O)c2ccccc2OCc2cscn2)cc1OC.
What is the InChIKey of N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide?
The InChIKey is TXUKJKACEYFFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S/c1-3-25-18-9-8-14(10-19(18)24-2)22-20(23)16-6-4-5-7-17(16)26-11-15-12-27-13-21-15/h4-10,12-13H,3,11H2,1-2H3,(H,22,23).
What are the key properties of N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide?
N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide has a molecular weight of 384.46 g/mol, XLogP of 4.38, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methoxyphenyl)-2-(1,3-thiazol-4-ylmethoxy)benzamide is sourced from PubChem (CID 78816507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).