3-bromo-2-methylquinolin-4-amine;hydrochloride

C10H10BrClN2 — CID 3022129

IUPAC3-bromo-2-methylquinolin-4-amine;hydrochloride
SMILESCc1nc2ccccc2c(N)c1Br.Cl
InChIInChI=1S/C10H9BrN2.ClH/c1-6-9(11)10(12)7-4-2-3-5-8(7)13-6;/h2-5H,1H3,(H2,12,13);1H
InChIKeyZHWTWQRZVCCJLG-UHFFFAOYSA-N
MW273.56 g/mol
LogP3.31
Rot. Bonds

About 3-bromo-2-methylquinolin-4-amine;hydrochloride

3-bromo-2-methylquinolin-4-amine;hydrochloride (PubChem CID 3022129) has the molecular formula C10H10BrClN2 and a molecular weight of 273.56 g/mol. Its IUPAC name is 3-bromo-2-methylquinolin-4-amine;hydrochloride.

Molecular Properties

Compound Name3-bromo-2-methylquinolin-4-amine;hydrochloride
PubChem CID3022129
Molecular FormulaC10H10BrClN2
Molecular Weight273.56 g/mol
Exact Mass271.97
IUPAC Name3-bromo-2-methylquinolin-4-amine;hydrochloride
SMILESCc1nc2ccccc2c(N)c1Br.Cl
InChIInChI=1S/C10H9BrN2.ClH/c1-6-9(11)10(12)7-4-2-3-5-8(7)13-6;/h2-5H,1H3,(H2,12,13);1H
InChIKeyZHWTWQRZVCCJLG-UHFFFAOYSA-N
XLogP3.31
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.56
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-bromo-2-methylquinolin-4-amine;hydrochloride?
The IUPAC name of 3-bromo-2-methylquinolin-4-amine;hydrochloride (CID 3022129) is 3-bromo-2-methylquinolin-4-amine;hydrochloride.
What is the SMILES notation for 3-bromo-2-methylquinolin-4-amine;hydrochloride?
The canonical SMILES for 3-bromo-2-methylquinolin-4-amine;hydrochloride is Cc1nc2ccccc2c(N)c1Br.Cl.
What is the InChIKey of 3-bromo-2-methylquinolin-4-amine;hydrochloride?
The InChIKey is ZHWTWQRZVCCJLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9BrN2.ClH/c1-6-9(11)10(12)7-4-2-3-5-8(7)13-6;/h2-5H,1H3,(H2,12,13);1H.
What are the key properties of 3-bromo-2-methylquinolin-4-amine;hydrochloride?
3-bromo-2-methylquinolin-4-amine;hydrochloride has a molecular weight of 273.56 g/mol, XLogP of 3.31, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-2-methylquinolin-4-amine;hydrochloride is sourced from PubChem (CID 3022129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).