3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide

C20H24N2O3 — CID 167854424

IUPAC3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)c1cccc(NC(C)=O)c1
InChIInChI=1S/C20H24N2O3/c1-13(23)21-16-8-6-7-14(11-16)19(24)22-17-12-15(20(2,3)4)9-10-18(17)25-5/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyQMILZUPOGWDCSW-UHFFFAOYSA-N
MW340.42 g/mol
LogP4.20
Rot. Bonds4

About 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide

3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide (PubChem CID 167854424) has the molecular formula C20H24N2O3 and a molecular weight of 340.42 g/mol. Its IUPAC name is 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide.

Molecular Properties

Compound Name3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide
PubChem CID167854424
Molecular FormulaC20H24N2O3
Molecular Weight340.42 g/mol
Exact Mass340.18
IUPAC Name3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)c1cccc(NC(C)=O)c1
InChIInChI=1S/C20H24N2O3/c1-13(23)21-16-8-6-7-14(11-16)19(24)22-17-12-15(20(2,3)4)9-10-18(17)25-5/h6-12H,1-5H3,(H,21,23)(H,22,24)
InChIKeyQMILZUPOGWDCSW-UHFFFAOYSA-N
XLogP4.20
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.42
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-bromo-N-(5-tert-butyl-2-methoxyphenyl)benzamide
CID 2669093
3-acetamido-N-(2-methoxy-5-propan-2-ylphenyl)benzamide
CID 110792606
3-acetamido-N-(3-acetylphenyl)-4-methoxybenzamide
CID 110764313
3-acetamido-N-(2,4-dimethoxy-3-methylphenyl)benzamide
CID 110792976
N-(3-acetamido-4-methoxyphenyl)-3-bromobenzamide
CID 35346015
3-acetamido-N-(4-amino-2-methoxyphenyl)benzamide
CID 28867873
N-(5-tert-butyl-2-methoxyphenyl)-4-propan-2-ylbenzamide
CID 7935956
N-(3-acetamidophenyl)-4-tert-butylbenzamide
CID 722339
N-(3-acetylphenyl)-4-tert-butylbenzamide
CID 722882
N-(5-acetamido-2-methoxyphenyl)-4-cyanobenzamide
CID 2450406
3-[(3-bromobenzoyl)amino]-N-(2-methoxyphenyl)benzamide
CID 52644751
N-(5-tert-butyl-2-methoxyphenyl)-2-fluorobenzamide
CID 2086520

Frequently Asked Questions

What is the IUPAC name of 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide?
The IUPAC name of 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide (CID 167854424) is 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide.
What is the SMILES notation for 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide?
The canonical SMILES for 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide is COc1ccc(C(C)(C)C)cc1NC(=O)c1cccc(NC(C)=O)c1.
What is the InChIKey of 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide?
The InChIKey is QMILZUPOGWDCSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O3/c1-13(23)21-16-8-6-7-14(11-16)19(24)22-17-12-15(20(2,3)4)9-10-18(17)25-5/h6-12H,1-5H3,(H,21,23)(H,22,24).
What are the key properties of 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide?
3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide has a molecular weight of 340.42 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-acetamido-N-(5-tert-butyl-2-methoxyphenyl)benzamide is sourced from PubChem (CID 167854424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).