8-bromo-5-methyl-N-propylquinolin-4-amine

C13H15BrN2 — CID 82758771

IUPAC8-bromo-5-methyl-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2c(Br)ccc(C)c12
InChIInChI=1S/C13H15BrN2/c1-3-7-15-11-6-8-16-13-10(14)5-4-9(2)12(11)13/h4-6,8H,3,7H2,1-2H3,(H,15,16)
InChIKeyJGABCBNRKQFQKY-UHFFFAOYSA-N
MW279.18 g/mol
LogP4.13
Rot. Bonds3

About 8-bromo-5-methyl-N-propylquinolin-4-amine

8-bromo-5-methyl-N-propylquinolin-4-amine (PubChem CID 82758771) has the molecular formula C13H15BrN2 and a molecular weight of 279.18 g/mol. Its IUPAC name is 8-bromo-5-methyl-N-propylquinolin-4-amine.

Molecular Properties

Compound Name8-bromo-5-methyl-N-propylquinolin-4-amine
PubChem CID82758771
Molecular FormulaC13H15BrN2
Molecular Weight279.18 g/mol
Exact Mass278.04
IUPAC Name8-bromo-5-methyl-N-propylquinolin-4-amine
SMILESCCCNc1ccnc2c(Br)ccc(C)c12
InChIInChI=1S/C13H15BrN2/c1-3-7-15-11-6-8-16-13-10(14)5-4-9(2)12(11)13/h4-6,8H,3,7H2,1-2H3,(H,15,16)
InChIKeyJGABCBNRKQFQKY-UHFFFAOYSA-N
XLogP4.13
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.18
LogP ≤ 54.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,8-dimethyl-N-propylquinolin-4-amine
CID 62191878
8-methoxy-5-methyl-N-propylquinolin-4-amine
CID 55045426
5,7-dimethyl-N-propylquinolin-4-amine
CID 62190648
8-bromo-5-methyl-4-(propylamino)quinoline-3-carbonitrile
CID 82758267
2,5,8-trimethyl-N-propylquinolin-4-amine
CID 63480948
8-chloro-5-methoxy-N-propylquinolin-4-amine
CID 62190827
5-chloro-8-methoxy-N-propylquinolin-4-amine
CID 55045427
5-bromo-8-methyl-N-propyl-2-(trifluoromethyl)quinolin-4-amine
CID 63479785
4,5,8-tribromoquinoline
CID 114764035
(8-bromo-5-methyl-2-propylquinolin-4-yl)hydrazine
CID 82758079
8-bromo-N-ethyl-5-methyl-2-(trifluoromethyl)quinolin-4-amine
CID 82758076
5,8-dibromo-3-ethyl-2-methyl-N-propylquinolin-4-amine
CID 63482930

Frequently Asked Questions

What is the IUPAC name of 8-bromo-5-methyl-N-propylquinolin-4-amine?
The IUPAC name of 8-bromo-5-methyl-N-propylquinolin-4-amine (CID 82758771) is 8-bromo-5-methyl-N-propylquinolin-4-amine.
What is the SMILES notation for 8-bromo-5-methyl-N-propylquinolin-4-amine?
The canonical SMILES for 8-bromo-5-methyl-N-propylquinolin-4-amine is CCCNc1ccnc2c(Br)ccc(C)c12.
What is the InChIKey of 8-bromo-5-methyl-N-propylquinolin-4-amine?
The InChIKey is JGABCBNRKQFQKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15BrN2/c1-3-7-15-11-6-8-16-13-10(14)5-4-9(2)12(11)13/h4-6,8H,3,7H2,1-2H3,(H,15,16).
What are the key properties of 8-bromo-5-methyl-N-propylquinolin-4-amine?
8-bromo-5-methyl-N-propylquinolin-4-amine has a molecular weight of 279.18 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-bromo-5-methyl-N-propylquinolin-4-amine is sourced from PubChem (CID 82758771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).