2,8a-dihydro-1H-1,8-naphthyridine

C8H8N2 — CID 138598725

IUPAC2,8a-dihydro-1H-1,8-naphthyridine
SMILESC1=CCNC2N=CC=CC=12
InChIInChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-3,5,8,10H,6H2
InChIKeyVVEGPJFPPMOMRH-UHFFFAOYSA-N
MW132.17 g/mol
LogP0.64
Rot. Bonds

About 2,8a-dihydro-1H-1,8-naphthyridine

2,8a-dihydro-1H-1,8-naphthyridine (PubChem CID 138598725) has the molecular formula C8H8N2 and a molecular weight of 132.17 g/mol. Its IUPAC name is 2,8a-dihydro-1H-1,8-naphthyridine.

Molecular Properties

Compound Name2,8a-dihydro-1H-1,8-naphthyridine
PubChem CID138598725
Molecular FormulaC8H8N2
Molecular Weight132.17 g/mol
Exact Mass132.07
IUPAC Name2,8a-dihydro-1H-1,8-naphthyridine
SMILESC1=CCNC2N=CC=CC=12
InChIInChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-3,5,8,10H,6H2
InChIKeyVVEGPJFPPMOMRH-UHFFFAOYSA-N
XLogP0.64
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.17
LogP ≤ 50.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,8a-Dihydro-1,8-naphthyridine
CID 18988805
1,2,4a,8a-Tetrahydropyrido[2,3-d]pyrimidine
CID 21838631
1,2,6,8a-Tetrahydropyrido[2,3-d]pyrimidine
CID 53976558
1,2,6,8a-Tetrahydroquinazoline
CID 91089711
1,2,6,8a-Tetrahydro-1,7-naphthyridine
CID 91151447
4-Methyl-1,8a-dihydro-1,8-naphthyridine
CID 141834232
2-Methyl-1,2,5,6-tetrahydroquinazoline
CID 143224358
4,4a-dihydro-3aH-pyrazolo[4,3-b][1,8]naphthyridine
CID 149253861
5-Methyl-2-(4-methylidenecyclohexa-1,5-dien-1-yl)-1,2,5,6-tetrahydropyrimidine
CID 163622803
1,2,5,8-Tetrahydro-1,6-naphthyridine
CID 173071985
1,2,5,8-Tetrahydro-1,6-naphthyridin-6-ium
CID 173109870
N-(5-methyl-1,2-dihydropyridin-6-yl)ethanimine
CID 174022081

Frequently Asked Questions

What is the IUPAC name of 2,8a-dihydro-1H-1,8-naphthyridine?
The IUPAC name of 2,8a-dihydro-1H-1,8-naphthyridine (CID 138598725) is 2,8a-dihydro-1H-1,8-naphthyridine.
What is the SMILES notation for 2,8a-dihydro-1H-1,8-naphthyridine?
The canonical SMILES for 2,8a-dihydro-1H-1,8-naphthyridine is C1=CCNC2N=CC=CC=12.
What is the InChIKey of 2,8a-dihydro-1H-1,8-naphthyridine?
The InChIKey is VVEGPJFPPMOMRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N2/c1-3-7-4-2-6-10-8(7)9-5-1/h1-3,5,8,10H,6H2.
What are the key properties of 2,8a-dihydro-1H-1,8-naphthyridine?
2,8a-dihydro-1H-1,8-naphthyridine has a molecular weight of 132.17 g/mol, XLogP of 0.64, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8a-dihydro-1H-1,8-naphthyridine is sourced from PubChem (CID 138598725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).