4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine

C10H12N2 — CID 74788088

IUPAC4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine
SMILESC=Cc1ccnc2c1CCNC2
InChIInChI=1S/C10H12N2/c1-2-8-3-6-12-10-7-11-5-4-9(8)10/h2-3,6,11H,1,4-5,7H2
InChIKeyXNFSSUBFJQLFJI-UHFFFAOYSA-N
MW160.22 g/mol
LogP1.37
Rot. Bonds1

About 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine

4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine (PubChem CID 74788088) has the molecular formula C10H12N2 and a molecular weight of 160.22 g/mol. Its IUPAC name is 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine.

Molecular Properties

Compound Name4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine
PubChem CID74788088
Molecular FormulaC10H12N2
Molecular Weight160.22 g/mol
Exact Mass160.10
IUPAC Name4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine
SMILESC=Cc1ccnc2c1CCNC2
InChIInChI=1S/C10H12N2/c1-2-8-3-6-12-10-7-11-5-4-9(8)10/h2-3,6,11H,1,4-5,7H2
InChIKeyXNFSSUBFJQLFJI-UHFFFAOYSA-N
XLogP1.37
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.22
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine?
The IUPAC name of 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine (CID 74788088) is 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine.
What is the SMILES notation for 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine?
The canonical SMILES for 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine is C=Cc1ccnc2c1CCNC2.
What is the InChIKey of 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine?
The InChIKey is XNFSSUBFJQLFJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N2/c1-2-8-3-6-12-10-7-11-5-4-9(8)10/h2-3,6,11H,1,4-5,7H2.
What are the key properties of 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine?
4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine has a molecular weight of 160.22 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-5,6,7,8-tetrahydro-1,7-naphthyridine is sourced from PubChem (CID 74788088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).