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

C12H10Cl2N2 — CID 62202722

IUPAC5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESNc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2
InChIInChI=1S/C12H10Cl2N2/c13-6-4-8-11(15)7-2-1-3-10(7)16-12(8)9(14)5-6/h4-5H,1-3H2,(H2,15,16)
InChIKeyDBVYKRKFXJOWLR-UHFFFAOYSA-N
MW253.13 g/mol
LogP3.61
Rot. Bonds

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

5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 62202722) has the molecular formula C12H10Cl2N2 and a molecular weight of 253.13 g/mol. Its IUPAC name is 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound Name5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID62202722
Molecular FormulaC12H10Cl2N2
Molecular Weight253.13 g/mol
Exact Mass252.02
IUPAC Name5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESNc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2
InChIInChI=1S/C12H10Cl2N2/c13-6-4-8-11(15)7-2-1-3-10(7)16-12(8)9(14)5-6/h4-5H,1-3H2,(H2,15,16)
InChIKeyDBVYKRKFXJOWLR-UHFFFAOYSA-N
XLogP3.61
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.13
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 62202722) is 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is Nc1c2c(nc3c(Cl)cc(Cl)cc13)CCC2.
What is the InChIKey of 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is DBVYKRKFXJOWLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10Cl2N2/c13-6-4-8-11(15)7-2-1-3-10(7)16-12(8)9(14)5-6/h4-5H,1-3H2,(H2,15,16).
What are the key properties of 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 253.13 g/mol, XLogP of 3.61, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dichloro-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 62202722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).