2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide

C19H20N4O2 — CID 2738917

IUPAC2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide
SMILESCOc1ccccc1CC(=O)NCc1nn(-c2ccccc2)nc1C
InChIInChI=1S/C19H20N4O2/c1-14-17(22-23(21-14)16-9-4-3-5-10-16)13-20-19(24)12-15-8-6-7-11-18(15)25-2/h3-11H,12-13H2,1-2H3,(H,20,24)
InChIKeyGVLHFIKOUFDPMM-UHFFFAOYSA-N
MW336.40 g/mol
LogP2.44
Rot. Bonds6

About 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide

2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide (PubChem CID 2738917) has the molecular formula C19H20N4O2 and a molecular weight of 336.40 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide
PubChem CID2738917
Molecular FormulaC19H20N4O2
Molecular Weight336.40 g/mol
Exact Mass336.16
IUPAC Name2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide
SMILESCOc1ccccc1CC(=O)NCc1nn(-c2ccccc2)nc1C
InChIInChI=1S/C19H20N4O2/c1-14-17(22-23(21-14)16-9-4-3-5-10-16)13-20-19(24)12-15-8-6-7-11-18(15)25-2/h3-11H,12-13H2,1-2H3,(H,20,24)
InChIKeyGVLHFIKOUFDPMM-UHFFFAOYSA-N
XLogP2.44
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.40
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide?
The IUPAC name of 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide (CID 2738917) is 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide.
What is the SMILES notation for 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide?
The canonical SMILES for 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide is COc1ccccc1CC(=O)NCc1nn(-c2ccccc2)nc1C.
What is the InChIKey of 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide?
The InChIKey is GVLHFIKOUFDPMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O2/c1-14-17(22-23(21-14)16-9-4-3-5-10-16)13-20-19(24)12-15-8-6-7-11-18(15)25-2/h3-11H,12-13H2,1-2H3,(H,20,24).
What are the key properties of 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide?
2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide has a molecular weight of 336.40 g/mol, XLogP of 2.44, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-N-[(5-methyl-2-phenyltriazol-4-yl)methyl]acetamide is sourced from PubChem (CID 2738917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).