7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C12H11BrN2 — CID 3041350

IUPAC7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESNc1c2c(nc3ccc(Br)cc13)CCC2
InChIInChI=1S/C12H11BrN2/c13-7-4-5-11-9(6-7)12(14)8-2-1-3-10(8)15-11/h4-6H,1-3H2,(H2,14,15)
InChIKeyVGQLZUNFVYTFBF-UHFFFAOYSA-N
MW263.14 g/mol
LogP3.07
Rot. Bonds

About 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 3041350) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID3041350
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESNc1c2c(nc3ccc(Br)cc13)CCC2
InChIInChI=1S/C12H11BrN2/c13-7-4-5-11-9(6-7)12(14)8-2-1-3-10(8)15-11/h4-6H,1-3H2,(H2,14,15)
InChIKeyVGQLZUNFVYTFBF-UHFFFAOYSA-N
XLogP3.07
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.14
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 3041350) is 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is Nc1c2c(nc3ccc(Br)cc13)CCC2.
What is the InChIKey of 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is VGQLZUNFVYTFBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2/c13-7-4-5-11-9(6-7)12(14)8-2-1-3-10(8)15-11/h4-6H,1-3H2,(H2,14,15).
What are the key properties of 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 263.14 g/mol, XLogP of 3.07, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 3041350), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).