2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide

C20H15ClN4O2 — CID 1221611

IUPAC2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccc2nn(-c3ccccc3)nc2c1
InChIInChI=1S/C20H15ClN4O2/c21-16-8-4-5-9-19(16)27-13-20(26)22-14-10-11-17-18(12-14)24-25(23-17)15-6-2-1-3-7-15/h1-12H,13H2,(H,22,26)
InChIKeyJVYQYSUYJQPPAC-UHFFFAOYSA-N
MW378.82 g/mol
LogP4.09
Rot. Bonds5

About 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide

2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide (PubChem CID 1221611) has the molecular formula C20H15ClN4O2 and a molecular weight of 378.82 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide
PubChem CID1221611
Molecular FormulaC20H15ClN4O2
Molecular Weight378.82 g/mol
Exact Mass378.09
IUPAC Name2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccc2nn(-c3ccccc3)nc2c1
InChIInChI=1S/C20H15ClN4O2/c21-16-8-4-5-9-19(16)27-13-20(26)22-14-10-11-17-18(12-14)24-25(23-17)15-6-2-1-3-7-15/h1-12H,13H2,(H,22,26)
InChIKeyJVYQYSUYJQPPAC-UHFFFAOYSA-N
XLogP4.09
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.82
LogP ≤ 54.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-methylphenoxy)-N-[2-(4-methylphenyl)-2H-benzotriazol-5-yl]acetamide
CID 1109840
2-(6-chlorobenzotriazol-1-yl)oxy-N-(2-ethoxyphenyl)acetamide
CID 2115266
N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]propanamide
CID 876205
N-[2-(4-ethoxyphenyl)benzotriazol-5-yl]-2-(2-methylphenoxy)acetamide
CID 2872381
N-[2-(3-chloro-4-methylphenyl)-2H-1,2,3-benzotriazol-5-yl]-2-phenoxyacetamide
CID 7831963
2-[2-(2H-1,2,3-benzotriazol-2-yl)-4-methylphenoxy]-N-(4-chlorophenyl)acetamide
CID 1249631
N-[2-(4-ethoxyphenyl)-2H-benzotriazol-5-yl]-2-phenoxyacetamide
CID 1367050
2-(4-methoxyphenoxy)-N-[2-(4-methoxyphenyl)-2H-benzotriazol-5-yl]acetamide
CID 1494242
2-(2-chloro-4-fluorophenoxy)-N-(3,5-dimethyl-1-phenylpyrazol-4-yl)acetamide
CID 2537230
N-[2-(4-ethylphenyl)-2H-benzotriazol-5-yl]-2-(4-methoxyphenoxy)acetamide
CID 3373903
N-(5-chloro-2,1,3-benzothiadiazol-4-yl)-2-phenoxyacetamide
CID 6458412
N-[2-(4-chlorophenyl)benzotriazol-5-yl]-2-(4-methylphenoxy)acetamide
CID 1341269

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide (CID 1221611) is 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide is O=C(COc1ccccc1Cl)Nc1ccc2nn(-c3ccccc3)nc2c1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide?
The InChIKey is JVYQYSUYJQPPAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClN4O2/c21-16-8-4-5-9-19(16)27-13-20(26)22-14-10-11-17-18(12-14)24-25(23-17)15-6-2-1-3-7-15/h1-12H,13H2,(H,22,26).
What are the key properties of 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide?
2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide has a molecular weight of 378.82 g/mol, XLogP of 4.09, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-(2-phenylbenzotriazol-5-yl)acetamide is sourced from PubChem (CID 1221611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).