N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

C23H26N2O2 — CID 2456629

IUPACN-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)CNc1cccc2ccccc12
InChIInChI=1S/C23H26N2O2/c1-23(2,3)17-12-13-21(27-4)20(14-17)25-22(26)15-24-19-11-7-9-16-8-5-6-10-18(16)19/h5-14,24H,15H2,1-4H3,(H,25,26)
InChIKeyOHUQZPTZTIKQSL-UHFFFAOYSA-N
MW362.47 g/mol
LogP5.20
Rot. Bonds5

About N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide

N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (PubChem CID 2456629) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.

Molecular Properties

Compound NameN-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
PubChem CID2456629
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
SMILESCOc1ccc(C(C)(C)C)cc1NC(=O)CNc1cccc2ccccc12
InChIInChI=1S/C23H26N2O2/c1-23(2,3)17-12-13-21(27-4)20(14-17)25-22(26)15-24-19-11-7-9-16-8-5-6-10-18(16)19/h5-14,24H,15H2,1-4H3,(H,25,26)
InChIKeyOHUQZPTZTIKQSL-UHFFFAOYSA-N
XLogP5.20
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.47
LogP ≤ 55.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3,4-dimethoxyphenyl)-2-(naphthalen-1-ylamino)acetamide
CID 9082418
N-(5-tert-butyl-2-methoxyphenyl)-2-(4-chloro-2,5-dimethoxyanilino)acetamide
CID 4885055
N-[5-(diethylsulfamoyl)-2-methoxyphenyl]-2-(naphthalen-1-ylamino)acetamide
CID 24510599
2-(5-bromo-2-methoxyanilino)-N-(2-methoxyphenyl)acetamide
CID 87030481
methyl 4-(5-tert-butyl-2-methoxyanilino)-4-oxobutanoate
CID 110776706
N-(5-tert-butyl-2-methoxyphenyl)-2-methoxyacetamide
CID 24657024
N-(5-tert-butyl-2-methoxyphenyl)-3-phenoxypropanamide
CID 4856932
N-(5-tert-butyl-2-methoxyphenyl)-3,3-diphenylpropanamide
CID 2457700
2-(1,2-dihydroacenaphthylen-5-ylamino)-N-(2-methoxyphenyl)acetamide
CID 35811813
2-(naphthalen-1-ylamino)-N-(2-propan-2-yloxyphenyl)acetamide
CID 54809130
N-(5-tert-butyl-2-methoxyphenyl)-3-cyanopropanamide
CID 115173479
2-(2-iodoanilino)-N-(2-methoxy-5-methylphenyl)acetamide
CID 26506643

Frequently Asked Questions

What is the IUPAC name of N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The IUPAC name of N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide (CID 2456629) is N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide.
What is the SMILES notation for N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The canonical SMILES for N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is COc1ccc(C(C)(C)C)cc1NC(=O)CNc1cccc2ccccc12.
What is the InChIKey of N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
The InChIKey is OHUQZPTZTIKQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-23(2,3)17-12-13-21(27-4)20(14-17)25-22(26)15-24-19-11-7-9-16-8-5-6-10-18(16)19/h5-14,24H,15H2,1-4H3,(H,25,26).
What are the key properties of N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide?
N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide has a molecular weight of 362.47 g/mol, XLogP of 5.20, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-tert-butyl-2-methoxyphenyl)-2-(naphthalen-1-ylamino)acetamide is sourced from PubChem (CID 2456629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).