6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine

C11H14N2 — CID 3058694

IUPAC6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESC=CCN1CCc2ncccc2C1
InChIInChI=1S/C11H14N2/c1-2-7-13-8-5-11-10(9-13)4-3-6-12-11/h2-4,6H,1,5,7-9H2
InChIKeyMHWQLNZJURVJNJ-UHFFFAOYSA-N
MW174.25 g/mol
LogP1.63
Rot. Bonds2

About 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine

6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine (PubChem CID 3058694) has the molecular formula C11H14N2 and a molecular weight of 174.25 g/mol. Its IUPAC name is 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine.

Molecular Properties

Compound Name6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine
PubChem CID3058694
Molecular FormulaC11H14N2
Molecular Weight174.25 g/mol
Exact Mass174.12
IUPAC Name6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine
SMILESC=CCN1CCc2ncccc2C1
InChIInChI=1S/C11H14N2/c1-2-7-13-8-5-11-10(9-13)4-3-6-12-11/h2-4,6H,1,5,7-9H2
InChIKeyMHWQLNZJURVJNJ-UHFFFAOYSA-N
XLogP1.63
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.25
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine?
The IUPAC name of 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine (CID 3058694) is 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine.
What is the SMILES notation for 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine?
The canonical SMILES for 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine is C=CCN1CCc2ncccc2C1.
What is the InChIKey of 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine?
The InChIKey is MHWQLNZJURVJNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2/c1-2-7-13-8-5-11-10(9-13)4-3-6-12-11/h2-4,6H,1,5,7-9H2.
What are the key properties of 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine?
6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine has a molecular weight of 174.25 g/mol, XLogP of 1.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-2-enyl-7,8-dihydro-5H-1,6-naphthyridine is sourced from PubChem (CID 3058694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).