N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

C18H15FN2 — CID 4187113

IUPACN-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESFc1ccc(Nc2c3c(nc4ccccc24)CCC3)cc1
InChIInChI=1S/C18H15FN2/c19-12-8-10-13(11-9-12)20-18-14-4-1-2-6-16(14)21-17-7-3-5-15(17)18/h1-2,4,6,8-11H,3,5,7H2,(H,20,21)
InChIKeyDLVFOWXHKPEVTF-UHFFFAOYSA-N
MW278.33 g/mol
LogP4.61
Rot. Bonds2

About N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine

N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (PubChem CID 4187113) has the molecular formula C18H15FN2 and a molecular weight of 278.33 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
PubChem CID4187113
Molecular FormulaC18H15FN2
Molecular Weight278.33 g/mol
Exact Mass278.12
IUPAC NameN-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine
SMILESFc1ccc(Nc2c3c(nc4ccccc24)CCC3)cc1
InChIInChI=1S/C18H15FN2/c19-12-8-10-13(11-9-12)20-18-14-4-1-2-6-16(14)21-17-7-3-5-15(17)18/h1-2,4,6,8-11H,3,5,7H2,(H,20,21)
InChIKeyDLVFOWXHKPEVTF-UHFFFAOYSA-N
XLogP4.61
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The IUPAC name of N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine (CID 4187113) is N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine.
What is the SMILES notation for N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The canonical SMILES for N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is Fc1ccc(Nc2c3c(nc4ccccc24)CCC3)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
The InChIKey is DLVFOWXHKPEVTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2/c19-12-8-10-13(11-9-12)20-18-14-4-1-2-6-16(14)21-17-7-3-5-15(17)18/h1-2,4,6,8-11H,3,5,7H2,(H,20,21).
What are the key properties of N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine?
N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine has a molecular weight of 278.33 g/mol, XLogP of 4.61, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2,3-dihydro-1H-cyclopenta[b]quinolin-9-amine is sourced from PubChem (CID 4187113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).