4-ethenylquinolin-8-amine

C11H10N2 — CID 19592561

IUPAC4-ethenylquinolin-8-amine
SMILESC=Cc1ccnc2c(N)cccc12
InChIInChI=1S/C11H10N2/c1-2-8-6-7-13-11-9(8)4-3-5-10(11)12/h2-7H,1,12H2
InChIKeyOHYCKRVMQCPUDO-UHFFFAOYSA-N
MW170.21 g/mol
LogP2.46
Rot. Bonds1

About 4-ethenylquinolin-8-amine

4-ethenylquinolin-8-amine (PubChem CID 19592561) has the molecular formula C11H10N2 and a molecular weight of 170.21 g/mol. Its IUPAC name is 4-ethenylquinolin-8-amine.

Molecular Properties

Compound Name4-ethenylquinolin-8-amine
PubChem CID19592561
Molecular FormulaC11H10N2
Molecular Weight170.21 g/mol
Exact Mass170.08
IUPAC Name4-ethenylquinolin-8-amine
SMILESC=Cc1ccnc2c(N)cccc12
InChIInChI=1S/C11H10N2/c1-2-8-6-7-13-11-9(8)4-3-5-10(11)12/h2-7H,1,12H2
InChIKeyOHYCKRVMQCPUDO-UHFFFAOYSA-N
XLogP2.46
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethenylquinolin-8-amine?
The IUPAC name of 4-ethenylquinolin-8-amine (CID 19592561) is 4-ethenylquinolin-8-amine.
What is the SMILES notation for 4-ethenylquinolin-8-amine?
The canonical SMILES for 4-ethenylquinolin-8-amine is C=Cc1ccnc2c(N)cccc12.
What is the InChIKey of 4-ethenylquinolin-8-amine?
The InChIKey is OHYCKRVMQCPUDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2/c1-2-8-6-7-13-11-9(8)4-3-5-10(11)12/h2-7H,1,12H2.
What are the key properties of 4-ethenylquinolin-8-amine?
4-ethenylquinolin-8-amine has a molecular weight of 170.21 g/mol, XLogP of 2.46, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenylquinolin-8-amine is sourced from PubChem (CID 19592561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).