7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine

C19H24N6 — CID 147204907

IUPAC7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine
SMILESCc1ncc(C)n2nc(CCc3ccc4c(n3)NC(C)(C)CC4)nc12
InChIInChI=1S/C19H24N6/c1-12-11-20-13(2)18-22-16(24-25(12)18)8-7-15-6-5-14-9-10-19(3,4)23-17(14)21-15/h5-6,11H,7-10H2,1-4H3,(H,21,23)
InChIKeyCEBNGQSDACTMTH-UHFFFAOYSA-N
MW336.44 g/mol
LogP3.06
Rot. Bonds3

About 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine

7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine (PubChem CID 147204907) has the molecular formula C19H24N6 and a molecular weight of 336.44 g/mol. Its IUPAC name is 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine.

Molecular Properties

Compound Name7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine
PubChem CID147204907
Molecular FormulaC19H24N6
Molecular Weight336.44 g/mol
Exact Mass336.21
IUPAC Name7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine
SMILESCc1ncc(C)n2nc(CCc3ccc4c(n3)NC(C)(C)CC4)nc12
InChIInChI=1S/C19H24N6/c1-12-11-20-13(2)18-22-16(24-25(12)18)8-7-15-6-5-14-9-10-19(3,4)23-17(14)21-15/h5-6,11H,7-10H2,1-4H3,(H,21,23)
InChIKeyCEBNGQSDACTMTH-UHFFFAOYSA-N
XLogP3.06
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.44
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine?
The IUPAC name of 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine (CID 147204907) is 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine.
What is the SMILES notation for 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine?
The canonical SMILES for 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine is Cc1ncc(C)n2nc(CCc3ccc4c(n3)NC(C)(C)CC4)nc12.
What is the InChIKey of 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine?
The InChIKey is CEBNGQSDACTMTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N6/c1-12-11-20-13(2)18-22-16(24-25(12)18)8-7-15-6-5-14-9-10-19(3,4)23-17(14)21-15/h5-6,11H,7-10H2,1-4H3,(H,21,23).
What are the key properties of 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine?
7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine has a molecular weight of 336.44 g/mol, XLogP of 3.06, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-(5,8-dimethyl-[1,2,4]triazolo[1,5-a]pyrazin-2-yl)ethyl]-2,2-dimethyl-3,4-dihydro-1H-1,8-naphthyridine is sourced from PubChem (CID 147204907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).