7-bromo-N-phenylquinolin-4-amine

C15H11BrN2 — CID 50877838

IUPAC7-bromo-N-phenylquinolin-4-amine
SMILESBrc1ccc2c(Nc3ccccc3)ccnc2c1
InChIInChI=1S/C15H11BrN2/c16-11-6-7-13-14(8-9-17-15(13)10-11)18-12-4-2-1-3-5-12/h1-10H,(H,17,18)
InChIKeyRYXUNSQQMIDPAQ-UHFFFAOYSA-N
MW299.17 g/mol
LogP4.74
Rot. Bonds2

About 7-bromo-N-phenylquinolin-4-amine

7-bromo-N-phenylquinolin-4-amine (PubChem CID 50877838) has the molecular formula C15H11BrN2 and a molecular weight of 299.17 g/mol. Its IUPAC name is 7-bromo-N-phenylquinolin-4-amine.

Molecular Properties

Compound Name7-bromo-N-phenylquinolin-4-amine
PubChem CID50877838
Molecular FormulaC15H11BrN2
Molecular Weight299.17 g/mol
Exact Mass298.01
IUPAC Name7-bromo-N-phenylquinolin-4-amine
SMILESBrc1ccc2c(Nc3ccccc3)ccnc2c1
InChIInChI=1S/C15H11BrN2/c16-11-6-7-13-14(8-9-17-15(13)10-11)18-12-4-2-1-3-5-12/h1-10H,(H,17,18)
InChIKeyRYXUNSQQMIDPAQ-UHFFFAOYSA-N
XLogP4.74
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.17
LogP ≤ 54.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-N-phenylquinolin-4-amine?
The IUPAC name of 7-bromo-N-phenylquinolin-4-amine (CID 50877838) is 7-bromo-N-phenylquinolin-4-amine.
What is the SMILES notation for 7-bromo-N-phenylquinolin-4-amine?
The canonical SMILES for 7-bromo-N-phenylquinolin-4-amine is Brc1ccc2c(Nc3ccccc3)ccnc2c1.
What is the InChIKey of 7-bromo-N-phenylquinolin-4-amine?
The InChIKey is RYXUNSQQMIDPAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2/c16-11-6-7-13-14(8-9-17-15(13)10-11)18-12-4-2-1-3-5-12/h1-10H,(H,17,18).
What are the key properties of 7-bromo-N-phenylquinolin-4-amine?
7-bromo-N-phenylquinolin-4-amine has a molecular weight of 299.17 g/mol, XLogP of 4.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N-phenylquinolin-4-amine is sourced from PubChem (CID 50877838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).