5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide

C19H20N4O3 — CID 16651697

IUPAC5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide
SMILESCOCc1c(C(=O)Nc2cccc(OC)c2)nnn1-c1cccc(C)c1
InChIInChI=1S/C19H20N4O3/c1-13-6-4-8-15(10-13)23-17(12-25-2)18(21-22-23)19(24)20-14-7-5-9-16(11-14)26-3/h4-11H,12H2,1-3H3,(H,20,24)
InChIKeyQGPYSYFSFUTVPQ-UHFFFAOYSA-N
MW352.39 g/mol
LogP2.98
Rot. Bonds6

About 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide

5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide (PubChem CID 16651697) has the molecular formula C19H20N4O3 and a molecular weight of 352.39 g/mol. Its IUPAC name is 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide.

Molecular Properties

Compound Name5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide
PubChem CID16651697
Molecular FormulaC19H20N4O3
Molecular Weight352.39 g/mol
Exact Mass352.15
IUPAC Name5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide
SMILESCOCc1c(C(=O)Nc2cccc(OC)c2)nnn1-c1cccc(C)c1
InChIInChI=1S/C19H20N4O3/c1-13-6-4-8-15(10-13)23-17(12-25-2)18(21-22-23)19(24)20-14-7-5-9-16(11-14)26-3/h4-11H,12H2,1-3H3,(H,20,24)
InChIKeyQGPYSYFSFUTVPQ-UHFFFAOYSA-N
XLogP2.98
TPSA78.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500352.39
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

5-(methoxymethyl)-N,1-bis(3-methylphenyl)triazole-4-carboxamide
CID 16651694
N-(2-chloro-5-methoxyphenyl)-5-(methoxymethyl)-1-(3-methylphenyl)triazole-4-carboxamide
CID 16651720
5-(methoxymethyl)-N-(2-methylphenyl)-1-(3-methylphenyl)triazole-4-carboxamide
CID 16651695
5-ethyl-N-(3-methoxyphenyl)-1-phenyltriazole-4-carboxamide
CID 15944215
N-(2-ethoxyphenyl)-5-(methoxymethyl)-1-(3-methylphenyl)triazole-4-carboxamide
CID 16651724
N-(5-acetyl-2-methoxyphenyl)-5-(methoxymethyl)-1-(3-methylphenyl)triazole-4-carboxamide
CID 16651776
1-(3-methoxyphenyl)-5-methyl-N-(3-phenoxyphenyl)triazole-4-carboxamide
CID 55667186
1-(3,5-dimethylphenyl)-N-(4-fluorophenyl)-5-(methoxymethyl)triazole-4-carboxamide
CID 17014875
N-[3-[[2-(2-methoxyphenoxy)acetyl]amino]phenyl]-5-methyl-1-(3-methylphenyl)triazole-4-carboxamide
CID 55887228
1-(3-methoxyphenyl)-5-methyl-N-[3-(trifluoromethyl)phenyl]triazole-4-carboxamide
CID 16648432
5-amino-1-(3-chlorophenyl)-N-(3-methoxyphenyl)triazole-4-carboxamide
CID 17015748
N-(2,4-dimethylphenyl)-5-(methoxymethyl)-1-phenyltriazole-4-carboxamide
CID 16651250

Frequently Asked Questions

What is the IUPAC name of 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide?
The IUPAC name of 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide (CID 16651697) is 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide.
What is the SMILES notation for 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide?
The canonical SMILES for 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide is COCc1c(C(=O)Nc2cccc(OC)c2)nnn1-c1cccc(C)c1.
What is the InChIKey of 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide?
The InChIKey is QGPYSYFSFUTVPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4O3/c1-13-6-4-8-15(10-13)23-17(12-25-2)18(21-22-23)19(24)20-14-7-5-9-16(11-14)26-3/h4-11H,12H2,1-3H3,(H,20,24).
What are the key properties of 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide?
5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide has a molecular weight of 352.39 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(methoxymethyl)-N-(3-methoxyphenyl)-1-(3-methylphenyl)triazole-4-carboxamide is sourced from PubChem (CID 16651697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).