2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine

C7H8N2O2 — CID 15633302

IUPAC2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine
SMILESNc1ccc2c(n1)OCCO2
InChIInChI=1S/C7H8N2O2/c8-6-2-1-5-7(9-6)11-4-3-10-5/h1-2H,3-4H2,(H2,8,9)
InChIKeyBNVIQBMDOURVEK-UHFFFAOYSA-N
MW152.15 g/mol
LogP0.44
Rot. Bonds

About 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine

2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine (PubChem CID 15633302) has the molecular formula C7H8N2O2 and a molecular weight of 152.15 g/mol. Its IUPAC name is 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine.

Molecular Properties

Compound Name2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine
PubChem CID15633302
Molecular FormulaC7H8N2O2
Molecular Weight152.15 g/mol
Exact Mass152.06
IUPAC Name2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine
SMILESNc1ccc2c(n1)OCCO2
InChIInChI=1S/C7H8N2O2/c8-6-2-1-5-7(9-6)11-4-3-10-5/h1-2H,3-4H2,(H2,8,9)
InChIKeyBNVIQBMDOURVEK-UHFFFAOYSA-N
XLogP0.44
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.15
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine?
The IUPAC name of 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine (CID 15633302) is 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine.
What is the SMILES notation for 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine?
The canonical SMILES for 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine is Nc1ccc2c(n1)OCCO2.
What is the InChIKey of 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine?
The InChIKey is BNVIQBMDOURVEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N2O2/c8-6-2-1-5-7(9-6)11-4-3-10-5/h1-2H,3-4H2,(H2,8,9).
What are the key properties of 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine?
2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine has a molecular weight of 152.15 g/mol, XLogP of 0.44, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-6-amine is sourced from PubChem (CID 15633302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).