8-bromo-7-chloroquinolin-4-amine

C9H6BrClN2 — CID 103481461

IUPAC8-bromo-7-chloroquinolin-4-amine
SMILESNc1ccnc2c(Br)c(Cl)ccc12
InChIInChI=1S/C9H6BrClN2/c10-8-6(11)2-1-5-7(12)3-4-13-9(5)8/h1-4H,(H2,12,13)
InChIKeyFIWOLEXLXYRWQF-UHFFFAOYSA-N
MW257.52 g/mol
LogP3.23
Rot. Bonds

About 8-bromo-7-chloroquinolin-4-amine

8-bromo-7-chloroquinolin-4-amine (PubChem CID 103481461) has the molecular formula C9H6BrClN2 and a molecular weight of 257.52 g/mol. Its IUPAC name is 8-bromo-7-chloroquinolin-4-amine.

Molecular Properties

Compound Name8-bromo-7-chloroquinolin-4-amine
PubChem CID103481461
Molecular FormulaC9H6BrClN2
Molecular Weight257.52 g/mol
Exact Mass255.94
IUPAC Name8-bromo-7-chloroquinolin-4-amine
SMILESNc1ccnc2c(Br)c(Cl)ccc12
InChIInChI=1S/C9H6BrClN2/c10-8-6(11)2-1-5-7(12)3-4-13-9(5)8/h1-4H,(H2,12,13)
InChIKeyFIWOLEXLXYRWQF-UHFFFAOYSA-N
XLogP3.23
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.52
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dichloroquinolin-8-amine
CID 19592780
6,8-dichloroquinolin-4-amine
CID 16767412
3,8-dibromo-4,7-dichloroquinoline
CID 103481167
4-bromo-7,8-dichloroquinoline
CID 39346133
7-fluoro-8-iodoquinolin-4-amine
CID 130499461
6-chloro-8-iodoquinolin-4-amine
CID 107628509
6-bromo-7-chloro-3-ethoxy-1-methylpyrrolo[3,2-c]quinoline
CID 156882044
4-bromo-3-chloro-8-methyl-1,5-naphthyridine
CID 103416479
4-chloro-7-iodoquinolin-8-amine
CID 12604273
4-amino-3-bromopyridine-2-carbaldehyde
CID 118845870
5-bromo-4,8-dichloroquinoline
CID 62908568
8-(2,3-dichlorophenoxy)quinolin-5-amine
CID 43450313

Frequently Asked Questions

What is the IUPAC name of 8-bromo-7-chloroquinolin-4-amine?
The IUPAC name of 8-bromo-7-chloroquinolin-4-amine (CID 103481461) is 8-bromo-7-chloroquinolin-4-amine.
What is the SMILES notation for 8-bromo-7-chloroquinolin-4-amine?
The canonical SMILES for 8-bromo-7-chloroquinolin-4-amine is Nc1ccnc2c(Br)c(Cl)ccc12.
What is the InChIKey of 8-bromo-7-chloroquinolin-4-amine?
The InChIKey is FIWOLEXLXYRWQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6BrClN2/c10-8-6(11)2-1-5-7(12)3-4-13-9(5)8/h1-4H,(H2,12,13).
What are the key properties of 8-bromo-7-chloroquinolin-4-amine?
8-bromo-7-chloroquinolin-4-amine has a molecular weight of 257.52 g/mol, XLogP of 3.23, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-7-chloroquinolin-4-amine is sourced from PubChem (CID 103481461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).