5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine

C19H21N5O — CID 53250651

IUPAC5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc(-c2cn(C)c(CCc3nc4c(C)ccc(C)n4n3)n2)o1
InChIInChI=1S/C19H21N5O/c1-12-5-6-13(2)24-19(12)21-17(22-24)9-10-18-20-15(11-23(18)4)16-8-7-14(3)25-16/h5-8,11H,9-10H2,1-4H3
InChIKeyWMHWBZLUHZRYKX-UHFFFAOYSA-N
MW335.41 g/mol
LogP3.43
Rot. Bonds4

About 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine

5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 53250651) has the molecular formula C19H21N5O and a molecular weight of 335.41 g/mol. Its IUPAC name is 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID53250651
Molecular FormulaC19H21N5O
Molecular Weight335.41 g/mol
Exact Mass335.17
IUPAC Name5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESCc1ccc(-c2cn(C)c(CCc3nc4c(C)ccc(C)n4n3)n2)o1
InChIInChI=1S/C19H21N5O/c1-12-5-6-13(2)24-19(12)21-17(22-24)9-10-18-20-15(11-23(18)4)16-8-7-14(3)25-16/h5-8,11H,9-10H2,1-4H3
InChIKeyWMHWBZLUHZRYKX-UHFFFAOYSA-N
XLogP3.43
TPSA61.15 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine (CID 53250651) is 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine is Cc1ccc(-c2cn(C)c(CCc3nc4c(C)ccc(C)n4n3)n2)o1.
What is the InChIKey of 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is WMHWBZLUHZRYKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N5O/c1-12-5-6-13(2)24-19(12)21-17(22-24)9-10-18-20-15(11-23(18)4)16-8-7-14(3)25-16/h5-8,11H,9-10H2,1-4H3.
What are the key properties of 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine?
5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 335.41 g/mol, XLogP of 3.43, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-dimethyl-2-[2-[1-methyl-4-(5-methylfuran-2-yl)imidazol-2-yl]ethyl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 53250651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).