1-ethyl-3,6,8-trimethyl-2,7-naphthyridine

C13H16N2 — CID 639524

IUPAC1-ethyl-3,6,8-trimethyl-2,7-naphthyridine
SMILESCCc1nc(C)cc2cc(C)nc(C)c12
InChIInChI=1S/C13H16N2/c1-5-12-13-10(4)14-8(2)6-11(13)7-9(3)15-12/h6-7H,5H2,1-4H3
InChIKeyYYIJMFOUUSNBGK-UHFFFAOYSA-N
MW200.28 g/mol
LogP3.12
Rot. Bonds1

About 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine

1-ethyl-3,6,8-trimethyl-2,7-naphthyridine (PubChem CID 639524) has the molecular formula C13H16N2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine.

Molecular Properties

Compound Name1-ethyl-3,6,8-trimethyl-2,7-naphthyridine
PubChem CID639524
Molecular FormulaC13H16N2
Molecular Weight200.28 g/mol
Exact Mass200.13
IUPAC Name1-ethyl-3,6,8-trimethyl-2,7-naphthyridine
SMILESCCc1nc(C)cc2cc(C)nc(C)c12
InChIInChI=1S/C13H16N2/c1-5-12-13-10(4)14-8(2)6-11(13)7-9(3)15-12/h6-7H,5H2,1-4H3
InChIKeyYYIJMFOUUSNBGK-UHFFFAOYSA-N
XLogP3.12
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine?
The IUPAC name of 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine (CID 639524) is 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine.
What is the SMILES notation for 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine?
The canonical SMILES for 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine is CCc1nc(C)cc2cc(C)nc(C)c12.
What is the InChIKey of 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine?
The InChIKey is YYIJMFOUUSNBGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16N2/c1-5-12-13-10(4)14-8(2)6-11(13)7-9(3)15-12/h6-7H,5H2,1-4H3.
What are the key properties of 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine?
1-ethyl-3,6,8-trimethyl-2,7-naphthyridine has a molecular weight of 200.28 g/mol, XLogP of 3.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-3,6,8-trimethyl-2,7-naphthyridine is sourced from PubChem (CID 639524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).