6,7,8,8a-tetrahydro-1,7-naphthyridine

C8H10N2 — CID 123937552

IUPAC6,7,8,8a-tetrahydro-1,7-naphthyridine
SMILESC1=CC2=CCNCC2N=C1
InChIInChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h1-4,8-9H,5-6H2
InChIKeyIDNCJDVLTYCHKC-UHFFFAOYSA-N
MW134.18 g/mol
LogP0.53
Rot. Bonds

About 6,7,8,8a-tetrahydro-1,7-naphthyridine

6,7,8,8a-tetrahydro-1,7-naphthyridine (PubChem CID 123937552) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 6,7,8,8a-tetrahydro-1,7-naphthyridine.

Molecular Properties

Compound Name6,7,8,8a-tetrahydro-1,7-naphthyridine
PubChem CID123937552
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name6,7,8,8a-tetrahydro-1,7-naphthyridine
SMILESC1=CC2=CCNCC2N=C1
InChIInChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h1-4,8-9H,5-6H2
InChIKeyIDNCJDVLTYCHKC-UHFFFAOYSA-N
XLogP0.53
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,7,8,8a-tetrahydro-1,7-naphthyridine?
The IUPAC name of 6,7,8,8a-tetrahydro-1,7-naphthyridine (CID 123937552) is 6,7,8,8a-tetrahydro-1,7-naphthyridine.
What is the SMILES notation for 6,7,8,8a-tetrahydro-1,7-naphthyridine?
The canonical SMILES for 6,7,8,8a-tetrahydro-1,7-naphthyridine is C1=CC2=CCNCC2N=C1.
What is the InChIKey of 6,7,8,8a-tetrahydro-1,7-naphthyridine?
The InChIKey is IDNCJDVLTYCHKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h1-4,8-9H,5-6H2.
What are the key properties of 6,7,8,8a-tetrahydro-1,7-naphthyridine?
6,7,8,8a-tetrahydro-1,7-naphthyridine has a molecular weight of 134.18 g/mol, XLogP of 0.53, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7,8,8a-tetrahydro-1,7-naphthyridine is sourced from PubChem (CID 123937552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).