2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide

C16H16N4O3 — CID 7668398

IUPAC2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COn1nnc2ccccc21
InChIInChI=1S/C16H16N4O3/c1-11-7-8-15(22-2)13(9-11)17-16(21)10-23-20-14-6-4-3-5-12(14)18-19-20/h3-9H,10H2,1-2H3,(H,17,21)
InChIKeyQBNXBMSGXPQMBC-UHFFFAOYSA-N
MW312.33 g/mol
LogP1.82
Rot. Bonds5

About 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide

2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide (PubChem CID 7668398) has the molecular formula C16H16N4O3 and a molecular weight of 312.33 g/mol. Its IUPAC name is 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide
PubChem CID7668398
Molecular FormulaC16H16N4O3
Molecular Weight312.33 g/mol
Exact Mass312.12
IUPAC Name2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide
SMILESCOc1ccc(C)cc1NC(=O)COn1nnc2ccccc21
InChIInChI=1S/C16H16N4O3/c1-11-7-8-15(22-2)13(9-11)17-16(21)10-23-20-14-6-4-3-5-12(14)18-19-20/h3-9H,10H2,1-2H3,(H,17,21)
InChIKeyQBNXBMSGXPQMBC-UHFFFAOYSA-N
XLogP1.82
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.33
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(benzotriazol-1-yloxy)-N-(3-methylphenyl)acetamide
CID 7668396
2-[2-(benzylamino)benzimidazol-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 9119353
2-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]sulfanyl-N-(2-methoxy-5-methylphenyl)acetamide
CID 1447930
[2-(2-methoxy-5-methylanilino)-2-oxo-1-phenylethyl] 2-(benzotriazol-1-yl)acetate
CID 18276877
N-(5-acetamido-2-methoxyphenyl)-2-(benzotriazol-1-yl)acetamide
CID 17457964
2-(benzotriazol-1-yl)-N-(5-tert-butyl-2-methoxyphenyl)acetamide
CID 8002209
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] 2-methoxybenzoate
CID 2715006
[2-(2-methoxy-5-methylanilino)-2-oxoethyl] 2-(2-methylphenyl)acetate
CID 8983228
N-(2-methoxy-5-methylphenyl)-2-[2-(trifluoromethyl)phenoxy]acetamide
CID 51283496
N-(2-bromo-4-methylphenyl)-2-(6-chlorobenzotriazol-1-yl)oxyacetamide
CID 2695468
2-[1-[2-(2-methoxy-5-methylanilino)-2-oxoethyl]benzimidazol-2-yl]-N-methylacetamide
CID 1153614
N-(2-methoxy-5-methylphenyl)-2-propan-2-yloxyacetamide
CID 47410584

Frequently Asked Questions

What is the IUPAC name of 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The IUPAC name of 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide (CID 7668398) is 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide.
What is the SMILES notation for 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The canonical SMILES for 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide is COc1ccc(C)cc1NC(=O)COn1nnc2ccccc21.
What is the InChIKey of 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide?
The InChIKey is QBNXBMSGXPQMBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4O3/c1-11-7-8-15(22-2)13(9-11)17-16(21)10-23-20-14-6-4-3-5-12(14)18-19-20/h3-9H,10H2,1-2H3,(H,17,21).
What are the key properties of 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide?
2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide has a molecular weight of 312.33 g/mol, XLogP of 1.82, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzotriazol-1-yloxy)-N-(2-methoxy-5-methylphenyl)acetamide is sourced from PubChem (CID 7668398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).