2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide

C20H14Cl2N4O2 — CID 4502278

IUPAC2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
InChIInChI=1S/C20H14Cl2N4O2/c21-14-8-4-5-9-19(14)28-12-20(27)23-16-11-18-17(10-15(16)22)24-26(25-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,23,27)
InChIKeyCAWDYEMMVGDLHW-UHFFFAOYSA-N
MW413.26 g/mol
LogP4.74
Rot. Bonds5

About 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide

2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide (PubChem CID 4502278) has the molecular formula C20H14Cl2N4O2 and a molecular weight of 413.26 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide
PubChem CID4502278
Molecular FormulaC20H14Cl2N4O2
Molecular Weight413.26 g/mol
Exact Mass412.05
IUPAC Name2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide
SMILESO=C(COc1ccccc1Cl)Nc1cc2nn(-c3ccccc3)nc2cc1Cl
InChIInChI=1S/C20H14Cl2N4O2/c21-14-8-4-5-9-19(14)28-12-20(27)23-16-11-18-17(10-15(16)22)24-26(25-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,23,27)
InChIKeyCAWDYEMMVGDLHW-UHFFFAOYSA-N
XLogP4.74
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.26
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide
CID 1292982
N-(6-chloro-2-phenylbenzotriazol-5-yl)-2-(2,4-dichloro-6-methylphenoxy)acetamide
CID 17220325
2-(2-chlorophenoxy)-N-[2-[[2-(2-chlorophenoxy)acetyl]amino]phenyl]acetamide
CID 1032604
2-(2-chlorophenoxy)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 8753073
2-(2-chlorophenoxy)-N-[2-[4-(diethylamino)-2-methylphenyl]-6-methylbenzotriazol-5-yl]acetamide
CID 17117401
2-(2-chlorophenoxy)-N-[6-[[2-(2-chlorophenoxy)acetyl]amino]-2-pyridinyl]acetamide
CID 1342446
2-(2-chlorophenoxy)-N-phenylacetamide
CID 853450
N-(5-amino-2-fluorophenyl)-2-(2-chlorophenoxy)acetamide
CID 16783197
2-(2-chlorophenoxy)-N-hydroxyacetamide
CID 95562486
3-butan-2-yloxy-N-(6-chloro-2-phenylbenzotriazol-5-yl)benzamide
CID 17220322
2-(2-chlorophenoxy)-N-(2-phenylmethoxyphenyl)acetamide
CID 17093502
2-(2-chlorophenoxy)-N-quinolin-8-ylacetamide
CID 952634

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide (CID 4502278) is 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide is O=C(COc1ccccc1Cl)Nc1cc2nn(-c3ccccc3)nc2cc1Cl.
What is the InChIKey of 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide?
The InChIKey is CAWDYEMMVGDLHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14Cl2N4O2/c21-14-8-4-5-9-19(14)28-12-20(27)23-16-11-18-17(10-15(16)22)24-26(25-18)13-6-2-1-3-7-13/h1-11H,12H2,(H,23,27).
What are the key properties of 2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide?
2-(2-chlorophenoxy)-N-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide has a molecular weight of 413.26 g/mol, XLogP of 4.74, 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-(6-chloro-2-phenylbenzotriazol-5-yl)acetamide is sourced from PubChem (CID 4502278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).