2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide

C12H10Cl2N4O2 — CID 3618480

IUPAC2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)Cc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C12H10Cl2N4O2/c1-20-8-5-3-2-4-7(8)15-10(19)6-9-16-11(13)18-12(14)17-9/h2-5H,6H2,1H3,(H,15,19)
InChIKeyLHUVHEZZBXMWNP-UHFFFAOYSA-N
MW313.14 g/mol
LogP2.37
Rot. Bonds4

About 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide

2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide (PubChem CID 3618480) has the molecular formula C12H10Cl2N4O2 and a molecular weight of 313.14 g/mol. Its IUPAC name is 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide
PubChem CID3618480
Molecular FormulaC12H10Cl2N4O2
Molecular Weight313.14 g/mol
Exact Mass312.02
IUPAC Name2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)Cc1nc(Cl)nc(Cl)n1
InChIInChI=1S/C12H10Cl2N4O2/c1-20-8-5-3-2-4-7(8)15-10(19)6-9-16-11(13)18-12(14)17-9/h2-5H,6H2,1H3,(H,15,19)
InChIKeyLHUVHEZZBXMWNP-UHFFFAOYSA-N
XLogP2.37
TPSA77.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.14
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-hydroxyphenyl)-N-(2-methoxyphenyl)acetamide
CID 60615730
N-(2-methoxyphenyl)-2-(2-methyl-1,3-thiazol-4-yl)acetamide
CID 29453114
N-(2-methoxyphenyl)-2-(3,4,5-trimethoxyphenyl)acetamide
CID 2599423
3-(2-chlorophenyl)-N-(2-methoxyphenyl)propanamide
CID 17178984
2-anthracen-9-yl-N-(2-methoxyphenyl)acetamide
CID 102391843
2-(4-acetamidophenyl)-N-(2-methoxyphenyl)acetamide
CID 17410326
2-[[2-(2-methoxyanilino)-2-oxoethyl]disulfanyl]-N-(2-methoxyphenyl)acetamide
CID 2346844
N,3-bis(2-methoxyphenyl)propanamide
CID 17394407
3-[(3,5-dichloro-2,6-dimethyl-4-pyridinyl)oxy]-N-(2-methoxyphenyl)propanamide
CID 134064601
N-(2-methoxyphenyl)-3-(methylamino)propanamide
CID 54773589
N-(2-methoxyphenyl)-3-oxo-3-phenylpropanamide
CID 7079
2-[5-(azepan-1-ylmethyl)-1,2,4-oxadiazol-3-yl]-N-(2-methoxyphenyl)acetamide
CID 27100650

Frequently Asked Questions

What is the IUPAC name of 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide (CID 3618480) is 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)Cc1nc(Cl)nc(Cl)n1.
What is the InChIKey of 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide?
The InChIKey is LHUVHEZZBXMWNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N4O2/c1-20-8-5-3-2-4-7(8)15-10(19)6-9-16-11(13)18-12(14)17-9/h2-5H,6H2,1H3,(H,15,19).
What are the key properties of 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide?
2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide has a molecular weight of 313.14 g/mol, XLogP of 2.37, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,6-dichloro-1,3,5-triazin-2-yl)-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 3618480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).