N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide

C19H18N4O2 — CID 142822117

IUPACN-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide
SMILESC=C1C=NC(c2ccccc2)=NN1CC(=O)Nc1ccccc1OC
InChIInChI=1S/C19H18N4O2/c1-14-12-20-19(15-8-4-3-5-9-15)22-23(14)13-18(24)21-16-10-6-7-11-17(16)25-2/h3-12H,1,13H2,2H3,(H,21,24)
InChIKeyPLQOZCIAVZXNBU-UHFFFAOYSA-N
MW334.38 g/mol
LogP2.90
Rot. Bonds5

About N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide

N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide (PubChem CID 142822117) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide
PubChem CID142822117
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide
SMILESC=C1C=NC(c2ccccc2)=NN1CC(=O)Nc1ccccc1OC
InChIInChI=1S/C19H18N4O2/c1-14-12-20-19(15-8-4-3-5-9-15)22-23(14)13-18(24)21-16-10-6-7-11-17(16)25-2/h3-12H,1,13H2,2H3,(H,21,24)
InChIKeyPLQOZCIAVZXNBU-UHFFFAOYSA-N
XLogP2.90
TPSA66.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 52.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide?
The IUPAC name of N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide (CID 142822117) is N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide.
What is the SMILES notation for N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide?
The canonical SMILES for N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide is C=C1C=NC(c2ccccc2)=NN1CC(=O)Nc1ccccc1OC.
What is the InChIKey of N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide?
The InChIKey is PLQOZCIAVZXNBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-14-12-20-19(15-8-4-3-5-9-15)22-23(14)13-18(24)21-16-10-6-7-11-17(16)25-2/h3-12H,1,13H2,2H3,(H,21,24).
What are the key properties of N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide?
N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide has a molecular weight of 334.38 g/mol, XLogP of 2.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-2-(6-methylidene-3-phenyl-1,2,4-triazin-1-yl)acetamide is sourced from PubChem (CID 142822117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).