2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

C15H11Cl2N5O2 — CID 47083831

IUPAC2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1cccnc1-n1cncn1
InChIInChI=1S/C15H11Cl2N5O2/c16-10-3-4-13(11(17)6-10)24-7-14(23)21-12-2-1-5-19-15(12)22-9-18-8-20-22/h1-6,8-9H,7H2,(H,21,23)
InChIKeyLQFWDJUTVZUQKR-UHFFFAOYSA-N
MW364.19 g/mol
LogP2.99
Rot. Bonds5

About 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide

2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (PubChem CID 47083831) has the molecular formula C15H11Cl2N5O2 and a molecular weight of 364.19 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
PubChem CID47083831
Molecular FormulaC15H11Cl2N5O2
Molecular Weight364.19 g/mol
Exact Mass363.03
IUPAC Name2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
SMILESO=C(COc1ccc(Cl)cc1Cl)Nc1cccnc1-n1cncn1
InChIInChI=1S/C15H11Cl2N5O2/c16-10-3-4-13(11(17)6-10)24-7-14(23)21-12-2-1-5-19-15(12)22-9-18-8-20-22/h1-6,8-9H,7H2,(H,21,23)
InChIKeyLQFWDJUTVZUQKR-UHFFFAOYSA-N
XLogP2.99
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.19
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-methoxy-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide
CID 62046673
2-(2,4-dichlorophenoxy)-N-quinolin-8-ylacetamide
CID 2180532
N-(2-chlorophenyl)-2-(2,4-dichlorophenoxy)acetamide
CID 744320
2-(2,4-dichlorophenoxy)-N-[2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]phenyl]acetamide
CID 2198238
2-(2,4-dichlorophenoxy)-N-pyridin-2-ylacetamide
CID 792334
N-(5-chloro-2-methoxyphenyl)-2-(1,2,4-triazol-1-yl)pyridine-3-carboxamide
CID 31700856
2-(4-chlorophenoxy)-N-(2-pyrazol-1-yl-3-pyridinyl)acetamide
CID 30884754
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(2,3-dimethylphenoxy)acetamide
CID 8794626
2-[2-[[2-(2,4-dichlorophenoxy)acetyl]amino]phenyl]acetic acid
CID 166178801
5-chloro-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]-1-benzofuran-2-carboxamide
CID 51098015
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-naphthalen-2-yloxyacetamide
CID 8794748
N-(5-chloro-2-fluorophenyl)-2-(5-chloroquinolin-8-yl)oxyacetamide
CID 8716254

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide (CID 47083831) is 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is O=C(COc1ccc(Cl)cc1Cl)Nc1cccnc1-n1cncn1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
The InChIKey is LQFWDJUTVZUQKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N5O2/c16-10-3-4-13(11(17)6-10)24-7-14(23)21-12-2-1-5-19-15(12)22-9-18-8-20-22/h1-6,8-9H,7H2,(H,21,23).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide?
2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide has a molecular weight of 364.19 g/mol, XLogP of 2.99, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-[2-(1,2,4-triazol-1-yl)-3-pyridinyl]acetamide is sourced from PubChem (CID 47083831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).