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

C14H15BrN2 — CID 62202889

IUPAC7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCNc1c2c(nc3c(C)cc(Br)cc13)CCC2
InChIInChI=1S/C14H15BrN2/c1-8-6-9(15)7-11-13(8)17-12-5-3-4-10(12)14(11)16-2/h6-7H,3-5H2,1-2H3,(H,16,17)
InChIKeyUEAYYJGKBVXVQZ-UHFFFAOYSA-N
MW291.19 g/mol
LogP3.84
Rot. Bonds1

About 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 62202889) has the molecular formula C14H15BrN2 and a molecular weight of 291.19 g/mol. Its IUPAC name is 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID62202889
Molecular FormulaC14H15BrN2
Molecular Weight291.19 g/mol
Exact Mass290.04
IUPAC Name7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESCNc1c2c(nc3c(C)cc(Br)cc13)CCC2
InChIInChI=1S/C14H15BrN2/c1-8-6-9(15)7-11-13(8)17-12-5-3-4-10(12)14(11)16-2/h6-7H,3-5H2,1-2H3,(H,16,17)
InChIKeyUEAYYJGKBVXVQZ-UHFFFAOYSA-N
XLogP3.84
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.19
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 62202889) is 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is CNc1c2c(nc3c(C)cc(Br)cc13)CCC2.
What is the InChIKey of 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is UEAYYJGKBVXVQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15BrN2/c1-8-6-9(15)7-11-13(8)17-12-5-3-4-10(12)14(11)16-2/h6-7H,3-5H2,1-2H3,(H,16,17).
What are the key properties of 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 291.19 g/mol, XLogP of 3.84, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-bromo-N,5-dimethyl-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 62202889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).