6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine

C13H14BrClN2 — CID 63479402

IUPAC6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine
SMILESCCCc1cc(NC)c2cc(Br)cc(Cl)c2n1
InChIInChI=1S/C13H14BrClN2/c1-3-4-9-7-12(16-2)10-5-8(14)6-11(15)13(10)17-9/h5-7H,3-4H2,1-2H3,(H,16,17)
InChIKeyULLAYSOMJRAMEW-UHFFFAOYSA-N
MW313.63 g/mol
LogP4.64
Rot. Bonds3

About 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine

6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine (PubChem CID 63479402) has the molecular formula C13H14BrClN2 and a molecular weight of 313.63 g/mol. Its IUPAC name is 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine.

Molecular Properties

Compound Name6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine
PubChem CID63479402
Molecular FormulaC13H14BrClN2
Molecular Weight313.63 g/mol
Exact Mass312.00
IUPAC Name6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine
SMILESCCCc1cc(NC)c2cc(Br)cc(Cl)c2n1
InChIInChI=1S/C13H14BrClN2/c1-3-4-9-7-12(16-2)10-5-8(14)6-11(15)13(10)17-9/h5-7H,3-4H2,1-2H3,(H,16,17)
InChIKeyULLAYSOMJRAMEW-UHFFFAOYSA-N
XLogP4.64
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.63
LogP ≤ 54.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-bromo-8-chloro-2-ethyl-N-methylquinolin-4-amine
CID 63479737
(6-bromo-8-chloro-2-propylquinolin-4-yl)hydrazine
CID 63483522
6-bromo-8-ethyl-N-methyl-2-propylquinolin-4-amine
CID 81288812
8-chloro-N-ethyl-6-methyl-2-propylquinolin-4-amine
CID 63479378
8-chloro-6-methyl-N,2-dipropylquinolin-4-amine
CID 63479380
8-bromo-N-methyl-2-propylquinolin-4-amine
CID 63479624
(8-chloro-6-iodo-2-propylquinolin-4-yl)hydrazine
CID 107607953
N,7,8-trimethyl-2-propylquinolin-4-amine
CID 63480138
6,8-dibromo-5-methoxy-N-methyl-2-propylquinolin-4-amine
CID 103416764
6-bromo-8-chloro-N-ethyl-2-(trifluoromethyl)quinolin-4-amine
CID 63479069
6-chloro-N-ethyl-8-methyl-2-propylquinolin-4-amine
CID 63480980
5,8-difluoro-N-methyl-2-propylquinolin-4-amine
CID 62203411

Frequently Asked Questions

What is the IUPAC name of 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine?
The IUPAC name of 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine (CID 63479402) is 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine.
What is the SMILES notation for 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine?
The canonical SMILES for 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine is CCCc1cc(NC)c2cc(Br)cc(Cl)c2n1.
What is the InChIKey of 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine?
The InChIKey is ULLAYSOMJRAMEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14BrClN2/c1-3-4-9-7-12(16-2)10-5-8(14)6-11(15)13(10)17-9/h5-7H,3-4H2,1-2H3,(H,16,17).
What are the key properties of 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine?
6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine has a molecular weight of 313.63 g/mol, XLogP of 4.64, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-8-chloro-N-methyl-2-propylquinolin-4-amine is sourced from PubChem (CID 63479402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).