N-(3-bromophenyl)quinolin-4-amine

C15H11BrN2 — CID 5328019

IUPACN-(3-bromophenyl)quinolin-4-amine
SMILESBrc1cccc(Nc2ccnc3ccccc23)c1
InChIInChI=1S/C15H11BrN2/c16-11-4-3-5-12(10-11)18-15-8-9-17-14-7-2-1-6-13(14)15/h1-10H,(H,17,18)
InChIKeyHANOGSNEKFKCMV-UHFFFAOYSA-N
MW299.17 g/mol
LogP4.74
Rot. Bonds2

About N-(3-bromophenyl)quinolin-4-amine

N-(3-bromophenyl)quinolin-4-amine (PubChem CID 5328019) has the molecular formula C15H11BrN2 and a molecular weight of 299.17 g/mol. Its IUPAC name is N-(3-bromophenyl)quinolin-4-amine.

Molecular Properties

Compound NameN-(3-bromophenyl)quinolin-4-amine
PubChem CID5328019
Molecular FormulaC15H11BrN2
Molecular Weight299.17 g/mol
Exact Mass298.01
IUPAC NameN-(3-bromophenyl)quinolin-4-amine
SMILESBrc1cccc(Nc2ccnc3ccccc23)c1
InChIInChI=1S/C15H11BrN2/c16-11-4-3-5-12(10-11)18-15-8-9-17-14-7-2-1-6-13(14)15/h1-10H,(H,17,18)
InChIKeyHANOGSNEKFKCMV-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 N-(3-bromophenyl)quinolin-4-amine?
The IUPAC name of N-(3-bromophenyl)quinolin-4-amine (CID 5328019) is N-(3-bromophenyl)quinolin-4-amine.
What is the SMILES notation for N-(3-bromophenyl)quinolin-4-amine?
The canonical SMILES for N-(3-bromophenyl)quinolin-4-amine is Brc1cccc(Nc2ccnc3ccccc23)c1.
What is the InChIKey of N-(3-bromophenyl)quinolin-4-amine?
The InChIKey is HANOGSNEKFKCMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11BrN2/c16-11-4-3-5-12(10-11)18-15-8-9-17-14-7-2-1-6-13(14)15/h1-10H,(H,17,18).
What are the key properties of N-(3-bromophenyl)quinolin-4-amine?
N-(3-bromophenyl)quinolin-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 N-(3-bromophenyl)quinolin-4-amine is sourced from PubChem (CID 5328019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).