N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide

C29H33N3O7 — CID 2901481

IUPACN-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
SMILESCOc1ccccc1OCC(=O)Nc1cc(NC(=O)COc2ccccc2OC)cc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C29H33N3O7/c1-29(2,3)32-28(35)19-14-20(30-26(33)17-38-24-12-8-6-10-22(24)36-4)16-21(15-19)31-27(34)18-39-25-13-9-7-11-23(25)37-5/h6-16H,17-18H2,1-5H3,(H,30,33)(H,31,34)(H,32,35)
InChIKeyORTGBNVGVSPAEZ-UHFFFAOYSA-N
MW535.60 g/mol
LogP4.27
Rot. Bonds11

About N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide

N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide (PubChem CID 2901481) has the molecular formula C29H33N3O7 and a molecular weight of 535.60 g/mol. Its IUPAC name is N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide.

Molecular Properties

Compound NameN-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
PubChem CID2901481
Molecular FormulaC29H33N3O7
Molecular Weight535.60 g/mol
Exact Mass535.23
IUPAC NameN-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
SMILESCOc1ccccc1OCC(=O)Nc1cc(NC(=O)COc2ccccc2OC)cc(C(=O)NC(C)(C)C)c1
InChIInChI=1S/C29H33N3O7/c1-29(2,3)32-28(35)19-14-20(30-26(33)17-38-24-12-8-6-10-22(24)36-4)16-21(15-19)31-27(34)18-39-25-13-9-7-11-23(25)37-5/h6-16H,17-18H2,1-5H3,(H,30,33)(H,31,34)(H,32,35)
InChIKeyORTGBNVGVSPAEZ-UHFFFAOYSA-N
XLogP4.27
TPSA124.22 Ų
H-Bond Donors3
H-Bond Acceptors7
Rotatable Bonds11
Heavy Atoms39
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500535.60
LogP ≤ 54.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 107

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Related Compounds

N-tert-butyl-3-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 9323551
5-[[2-(2-methoxyphenoxy)acetyl]amino]benzene-1,3-dicarboxylic acid
CID 880340
N-tert-butyl-2-(2-methoxyphenoxy)acetamide
CID 922262
N-tert-butyl-4-[[2-(2-ethylphenoxy)acetyl]amino]benzamide
CID 55549107
N-(2-tert-butyl-4-pyridinyl)-2-(2-methoxyphenoxy)acetamide
CID 110443287
N-(4-amino-3,5-dichlorophenyl)-2-(2-methoxyphenoxy)acetamide
CID 51193233
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
N-tert-butyl-3-[(2-methoxyacetyl)amino]benzamide
CID 47251267
N-[4-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-3-methylbenzamide
CID 17252265
2-(2-tert-butylphenoxy)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 24536655
N-(2-benzamidoethyl)-4-[[2-(2-methoxyphenoxy)acetyl]amino]benzamide
CID 121063227
2-(2-methoxyphenoxy)-N-[4-(3-methoxypropylamino)phenyl]acetamide
CID 112981073

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide?
The IUPAC name of N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide (CID 2901481) is N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide.
What is the SMILES notation for N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide?
The canonical SMILES for N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide is COc1ccccc1OCC(=O)Nc1cc(NC(=O)COc2ccccc2OC)cc(C(=O)NC(C)(C)C)c1.
What is the InChIKey of N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide?
The InChIKey is ORTGBNVGVSPAEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H33N3O7/c1-29(2,3)32-28(35)19-14-20(30-26(33)17-38-24-12-8-6-10-22(24)36-4)16-21(15-19)31-27(34)18-39-25-13-9-7-11-23(25)37-5/h6-16H,17-18H2,1-5H3,(H,30,33)(H,31,34)(H,32,35).
What are the key properties of N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide?
N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide has a molecular weight of 535.60 g/mol, XLogP of 4.27, 11 rotatable bonds, 3 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-3,5-bis[[2-(2-methoxyphenoxy)acetyl]amino]benzamide is sourced from PubChem (CID 2901481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).