5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C14H15BrN2 — CID 63479623

IUPAC5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCNc1c2c(nc3c(Br)cccc13)CCC2
InChIInChI=1S/C14H15BrN2/c1-2-16-13-9-5-4-8-12(9)17-14-10(13)6-3-7-11(14)15/h3,6-7H,2,4-5,8H2,1H3,(H,16,17)
InChIKeyMJTODZGMYYIYSQ-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.92
Rot. Bonds2

About 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 63479623) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID63479623
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCCNc1c2c(nc3c(Br)cccc13)CCC2
InChIInChI=1S/C14H15BrN2/c1-2-16-13-9-5-4-8-12(9)17-14-10(13)6-3-7-11(14)15/h3,6-7H,2,4-5,8H2,1H3,(H,16,17)
InChIKeyMJTODZGMYYIYSQ-UHFFFAOYSA-N
XLogP3.92
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-bromo-1H,2H,3H,4H,9H-pyrido(3,4-b)indole
CID 14680201
N'-(2,3-Dihydro-1H-cyclopenta[b]quinolin-9-yl)-N,N-dimethyl-ethane-1,2-diamine
CID 1570576
N'-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-N,N-dimethylpropane-1,3-diamine
CID 2790049
8-Bromo-2,3,4,9-tetrahydro-1H-beta-carboline
CID 10467319
8-Bromo-2,3,4,5-tetrahydro-2-methyl-1H-pyrido(4,3-b)indole
CID 199816
8-Bromo-4,9-dihydro-3H-beta-carboline
CID 44264251
7-Bromo-1,2,3,4-tetrahydroacridin-9-amine;hydrochloride
CID 164597080
7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine;hydrochloride
CID 164610387
N~1~-(2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)-N~3~,N~3~-dimethyl-1,3-propanediamine
CID 2790050
4-Amino-6-bromo-2-methylquinoline
CID 13415568
N',N'-dimethyl-N-(7-methyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl)propane-1,3-diamine
CID 3144393
5-bromo-2-methyl-3-(1,2,3,6-tetrahydropyridin-4-yl)-1H-indole
CID 73354882

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 63479623) is 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is CCNc1c2c(nc3c(Br)cccc13)CCC2.
What is the InChIKey of 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is MJTODZGMYYIYSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-2-16-13-9-5-4-8-12(9)17-14-10(13)6-3-7-11(14)15/h3,6-7H,2,4-5,8H2,1H3,(H,16,17).
What are the key properties of 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 291.19 g/mol, XLogP of 3.92, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-ethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 63479623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).