7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine

C10H13BrN2 — CID 83843274

IUPAC7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine
SMILESCN1CCC(N)c2ccc(Br)cc21
InChIInChI=1S/C10H13BrN2/c1-13-5-4-9(12)8-3-2-7(11)6-10(8)13/h2-3,6,9H,4-5,12H2,1H3
InChIKeySRGBMTJTLQCWLG-UHFFFAOYSA-N
MW241.13 g/mol
LogP2.29
Rot. Bonds

About 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine

7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine (PubChem CID 83843274) has the molecular formula C10H13BrN2 and a molecular weight of 241.13 g/mol. Its IUPAC name is 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine.

Molecular Properties

Compound Name7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine
PubChem CID83843274
Molecular FormulaC10H13BrN2
Molecular Weight241.13 g/mol
Exact Mass240.03
IUPAC Name7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine
SMILESCN1CCC(N)c2ccc(Br)cc21
InChIInChI=1S/C10H13BrN2/c1-13-5-4-9(12)8-3-2-7(11)6-10(8)13/h2-3,6,9H,4-5,12H2,1H3
InChIKeySRGBMTJTLQCWLG-UHFFFAOYSA-N
XLogP2.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.13
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine?
The IUPAC name of 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine (CID 83843274) is 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine.
What is the SMILES notation for 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine?
The canonical SMILES for 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine is CN1CCC(N)c2ccc(Br)cc21.
What is the InChIKey of 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine?
The InChIKey is SRGBMTJTLQCWLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13BrN2/c1-13-5-4-9(12)8-3-2-7(11)6-10(8)13/h2-3,6,9H,4-5,12H2,1H3.
What are the key properties of 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine?
7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine has a molecular weight of 241.13 g/mol, XLogP of 2.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-1-methyl-3,4-dihydro-2H-quinolin-4-amine is sourced from PubChem (CID 83843274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).