2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one

C10H11N3O — CID 141334590

IUPAC2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one
SMILESO=C1C2NC=CC=C2C=C2NCCN12
InChIInChI=1S/C10H11N3O/c14-10-9-7(2-1-3-12-9)6-8-11-4-5-13(8)10/h1-3,6,9,11-12H,4-5H2
InChIKeyLGTOYIKXNDTGPM-UHFFFAOYSA-N
MW189.22 g/mol
LogP-0.31
Rot. Bonds

About 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one

2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one (PubChem CID 141334590) has the molecular formula C10H11N3O and a molecular weight of 189.22 g/mol. Its IUPAC name is 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one.

Molecular Properties

Compound Name2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one
PubChem CID141334590
Molecular FormulaC10H11N3O
Molecular Weight189.22 g/mol
Exact Mass189.09
IUPAC Name2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one
SMILESO=C1C2NC=CC=C2C=C2NCCN12
InChIInChI=1S/C10H11N3O/c14-10-9-7(2-1-3-12-9)6-8-11-4-5-13(8)10/h1-3,6,9,11-12H,4-5H2
InChIKeyLGTOYIKXNDTGPM-UHFFFAOYSA-N
XLogP-0.31
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 5-0.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one?
The IUPAC name of 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one (CID 141334590) is 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one.
What is the SMILES notation for 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one?
The canonical SMILES for 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one is O=C1C2NC=CC=C2C=C2NCCN12.
What is the InChIKey of 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one?
The InChIKey is LGTOYIKXNDTGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O/c14-10-9-7(2-1-3-12-9)6-8-11-4-5-13(8)10/h1-3,6,9,11-12H,4-5H2.
What are the key properties of 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one?
2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one has a molecular weight of 189.22 g/mol, XLogP of -0.31, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5a,6-tetrahydro-1H-imidazo[2,1-g][1,7]naphthyridin-5-one is sourced from PubChem (CID 141334590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).