7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one

C18H14ClNO2 — CID 172712083

IUPAC7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
SMILESO=c1c2c([nH]c3ccc(Oc4ccc(Cl)cc4)cc13)CCC2
InChIInChI=1S/C18H14ClNO2/c19-11-4-6-12(7-5-11)22-13-8-9-17-15(10-13)18(21)14-2-1-3-16(14)20-17/h4-10H,1-3H2,(H,20,21)
InChIKeyFJPUKVJGPHFFTA-UHFFFAOYSA-N
MW311.77 g/mol
LogP4.46
Rot. Bonds2

About 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one

7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one (PubChem CID 172712083) has the molecular formula C18H14ClNO2 and a molecular weight of 311.77 g/mol. Its IUPAC name is 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one.

Molecular Properties

Compound Name7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
PubChem CID172712083
Molecular FormulaC18H14ClNO2
Molecular Weight311.77 g/mol
Exact Mass311.07
IUPAC Name7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
SMILESO=c1c2c([nH]c3ccc(Oc4ccc(Cl)cc4)cc13)CCC2
InChIInChI=1S/C18H14ClNO2/c19-11-4-6-12(7-5-11)22-13-8-9-17-15(10-13)18(21)14-2-1-3-16(14)20-17/h4-10H,1-3H2,(H,20,21)
InChIKeyFJPUKVJGPHFFTA-UHFFFAOYSA-N
XLogP4.46
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.77
LogP ≤ 54.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one with MolForge

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Related Compounds

7-tert-butyl-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
CID 58759349
2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one
CID 63351442
7-chloro-2,2-dimethyl-1,3,4,10-tetrahydroacridin-9-one
CID 53362205
7-nitro-2,3,4,10-tetrahydro-1H-acridin-9-one
CID 6324703
3-methoxy-6,7,8,9,10,11-hexahydro-5H-cycloocta[b]quinolin-12-one
CID 53362916
5,7-dichloro-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
CID 61381816
7-[4-(trifluoromethyl)phenyl]-2,3,4,10-tetrahydro-1H-acridin-9-one
CID 53362611
2-phenoxy-10H-acridin-9-one
CID 14029103
7-chloro-5-fluoro-2,3,4,10-tetrahydro-1H-acridin-9-one
CID 61382713
2-ethoxy-5,6,7,8,9,10-hexahydrocyclohepta[b]indole
CID 107958588
3-[4-(3-chlorophenoxy)phenyl]-2-methyl-5,6,7,8-tetrahydro-1H-quinolin-4-one;3-[4-(3-fluorophenoxy)phenyl]-2-methyl-5,6,7,8-tetrahydro-1H-quinolin-4-one
CID 158599165
7-methyl-1,2,3,4-tetrahydrocyclopenta[b]indole
CID 4770206

Frequently Asked Questions

What is the IUPAC name of 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one?
The IUPAC name of 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one (CID 172712083) is 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one.
What is the SMILES notation for 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one?
The canonical SMILES for 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one is O=c1c2c([nH]c3ccc(Oc4ccc(Cl)cc4)cc13)CCC2.
What is the InChIKey of 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one?
The InChIKey is FJPUKVJGPHFFTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClNO2/c19-11-4-6-12(7-5-11)22-13-8-9-17-15(10-13)18(21)14-2-1-3-16(14)20-17/h4-10H,1-3H2,(H,20,21).
What are the key properties of 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one?
7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one has a molecular weight of 311.77 g/mol, XLogP of 4.46, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one is sourced from PubChem (CID 172712083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).