8-bromo-2-methylquinolin-4-amine

C10H9BrN2 — CID 17039642

IUPAC8-bromo-2-methylquinolin-4-amine
SMILESCc1cc(N)c2cccc(Br)c2n1
InChIInChI=1S/C10H9BrN2/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3,(H2,12,13)
InChIKeyVXQZWWFUQGSMAV-UHFFFAOYSA-N
MW237.10 g/mol
LogP2.89
Rot. Bonds

About 8-bromo-2-methylquinolin-4-amine

8-bromo-2-methylquinolin-4-amine (PubChem CID 17039642) has the molecular formula C10H9BrN2 and a molecular weight of 237.10 g/mol. Its IUPAC name is 8-bromo-2-methylquinolin-4-amine.

Molecular Properties

Compound Name8-bromo-2-methylquinolin-4-amine
PubChem CID17039642
Molecular FormulaC10H9BrN2
Molecular Weight237.10 g/mol
Exact Mass235.99
IUPAC Name8-bromo-2-methylquinolin-4-amine
SMILESCc1cc(N)c2cccc(Br)c2n1
InChIInChI=1S/C10H9BrN2/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3,(H2,12,13)
InChIKeyVXQZWWFUQGSMAV-UHFFFAOYSA-N
XLogP2.89
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.10
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-bromo-2-methylquinolin-4-amine?
The IUPAC name of 8-bromo-2-methylquinolin-4-amine (CID 17039642) is 8-bromo-2-methylquinolin-4-amine.
What is the SMILES notation for 8-bromo-2-methylquinolin-4-amine?
The canonical SMILES for 8-bromo-2-methylquinolin-4-amine is Cc1cc(N)c2cccc(Br)c2n1.
What is the InChIKey of 8-bromo-2-methylquinolin-4-amine?
The InChIKey is VXQZWWFUQGSMAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2/c1-6-5-9(12)7-3-2-4-8(11)10(7)13-6/h2-5H,1H3,(H2,12,13).
What are the key properties of 8-bromo-2-methylquinolin-4-amine?
8-bromo-2-methylquinolin-4-amine has a molecular weight of 237.10 g/mol, XLogP of 2.89, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-2-methylquinolin-4-amine is sourced from PubChem (CID 17039642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).