2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol

C10H14N2O — CID 11367331

IUPAC2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol
SMILESOCCc1ccc2c(n1)NCCC2
InChIInChI=1S/C10H14N2O/c13-7-5-9-4-3-8-2-1-6-11-10(8)12-9/h3-4,13H,1-2,5-7H2,(H,11,12)
InChIKeyWEMUNMQFXOILNO-UHFFFAOYSA-N
MW178.23 g/mol
LogP0.97
Rot. Bonds2

About 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol

2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol (PubChem CID 11367331) has the molecular formula C10H14N2O and a molecular weight of 178.23 g/mol. Its IUPAC name is 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol.

Molecular Properties

Compound Name2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol
PubChem CID11367331
Molecular FormulaC10H14N2O
Molecular Weight178.23 g/mol
Exact Mass178.11
IUPAC Name2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol
SMILESOCCc1ccc2c(n1)NCCC2
InChIInChI=1S/C10H14N2O/c13-7-5-9-4-3-8-2-1-6-11-10(8)12-9/h3-4,13H,1-2,5-7H2,(H,11,12)
InChIKeyWEMUNMQFXOILNO-UHFFFAOYSA-N
XLogP0.97
TPSA45.15 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol?
The IUPAC name of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol (CID 11367331) is 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol.
What is the SMILES notation for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol?
The canonical SMILES for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol is OCCc1ccc2c(n1)NCCC2.
What is the InChIKey of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol?
The InChIKey is WEMUNMQFXOILNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O/c13-7-5-9-4-3-8-2-1-6-11-10(8)12-9/h3-4,13H,1-2,5-7H2,(H,11,12).
What are the key properties of 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol?
2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol has a molecular weight of 178.23 g/mol, XLogP of 0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5,6,7,8-tetrahydro-1,8-naphthyridin-2-yl)ethanol is sourced from PubChem (CID 11367331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).