7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine

C19H17N3O3 — CID 141034771

IUPAC7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccn3nc(-c4ccc(C)o4)nc3c2)cc1OC
InChIInChI=1S/C19H17N3O3/c1-12-4-6-16(25-12)19-20-18-11-14(8-9-22(18)21-19)13-5-7-15(23-2)17(10-13)24-3/h4-11H,1-3H3
InChIKeyWYGMAQFRQVMRBC-UHFFFAOYSA-N
MW335.36 g/mol
LogP3.98
Rot. Bonds4

About 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine

7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 141034771) has the molecular formula C19H17N3O3 and a molecular weight of 335.36 g/mol. Its IUPAC name is 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID141034771
Molecular FormulaC19H17N3O3
Molecular Weight335.36 g/mol
Exact Mass335.13
IUPAC Name7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine
SMILESCOc1ccc(-c2ccn3nc(-c4ccc(C)o4)nc3c2)cc1OC
InChIInChI=1S/C19H17N3O3/c1-12-4-6-16(25-12)19-20-18-11-14(8-9-22(18)21-19)13-5-7-15(23-2)17(10-13)24-3/h4-11H,1-3H3
InChIKeyWYGMAQFRQVMRBC-UHFFFAOYSA-N
XLogP3.98
TPSA61.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.36
LogP ≤ 53.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine with MolForge

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Related Compounds

2-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylic acid
CID 82566821
2-(5-bromofuran-2-yl)-7-methoxy-[1,2,4]triazolo[1,5-a]pyridine
CID 117134762
6-(3,4-dimethoxyphenyl)-2-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 155964904
7-(4-methoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 82556371
methyl 2-(5-chlorofuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-7-carboxylate
CID 117134866
2-(2-methoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridine
CID 16751701
2-(4-methoxyphenyl)-5-methylfuran
CID 11171456
2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine-6-carbaldehyde
CID 117130193
2-(3,4-dimethoxyphenyl)-[1,2,4]triazolo[1,5-a]pyridine-5-carbonitrile
CID 82567442
1,2-dimethoxy-4-(4-methylphenyl)benzene;ethane
CID 142094347
5-(3,4-dimethoxyphenyl)-2,4-dimethyl-1,3-oxazole
CID 13268420
6-(3,4-dimethoxyphenyl)-7-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-amine;hydrochloride
CID 66849631

Frequently Asked Questions

What is the IUPAC name of 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine (CID 141034771) is 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is COc1ccc(-c2ccn3nc(-c4ccc(C)o4)nc3c2)cc1OC.
What is the InChIKey of 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is WYGMAQFRQVMRBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N3O3/c1-12-4-6-16(25-12)19-20-18-11-14(8-9-22(18)21-19)13-5-7-15(23-2)17(10-13)24-3/h4-11H,1-3H3.
What are the key properties of 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine?
7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 335.36 g/mol, XLogP of 3.98, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(3,4-dimethoxyphenyl)-2-(5-methylfuran-2-yl)-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 141034771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).