1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol

C11H10N2O — CID 66614409

IUPAC1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol
SMILESC=CC(O)c1ccc2cccnc2n1
InChIInChI=1S/C11H10N2O/c1-2-10(14)9-6-5-8-4-3-7-12-11(8)13-9/h2-7,10,14H,1H2
InChIKeyOOHORYADMKJXOE-UHFFFAOYSA-N
MW186.21 g/mol
LogP1.85
Rot. Bonds2

About 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol

1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol (PubChem CID 66614409) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol.

Molecular Properties

Compound Name1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol
PubChem CID66614409
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol
SMILESC=CC(O)c1ccc2cccnc2n1
InChIInChI=1S/C11H10N2O/c1-2-10(14)9-6-5-8-4-3-7-12-11(8)13-9/h2-7,10,14H,1H2
InChIKeyOOHORYADMKJXOE-UHFFFAOYSA-N
XLogP1.85
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol 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 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol?
The IUPAC name of 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol (CID 66614409) is 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol.
What is the SMILES notation for 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol?
The canonical SMILES for 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol is C=CC(O)c1ccc2cccnc2n1.
What is the InChIKey of 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol?
The InChIKey is OOHORYADMKJXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c1-2-10(14)9-6-5-8-4-3-7-12-11(8)13-9/h2-7,10,14H,1H2.
What are the key properties of 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol?
1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol has a molecular weight of 186.21 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1,8-naphthyridin-2-yl)prop-2-en-1-ol is sourced from PubChem (CID 66614409), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).