3,5-dihydrocyclopenta[h]quinolin-4-one

C12H9NO — CID 139266878

IUPAC3,5-dihydrocyclopenta[h]quinolin-4-one
SMILESO=C1CC=NC2=C1CC=C1C=CC=C12
InChIInChI=1S/C12H9NO/c14-11-6-7-13-12-9-3-1-2-8(9)4-5-10(11)12/h1-4,7H,5-6H2
InChIKeyWYHGHGUJYFNRPT-UHFFFAOYSA-N
MW183.21 g/mol
LogP2.11
Rot. Bonds

About 3,5-dihydrocyclopenta[h]quinolin-4-one

3,5-dihydrocyclopenta[h]quinolin-4-one (PubChem CID 139266878) has the molecular formula C12H9NO and a molecular weight of 183.21 g/mol. Its IUPAC name is 3,5-dihydrocyclopenta[h]quinolin-4-one.

Molecular Properties

Compound Name3,5-dihydrocyclopenta[h]quinolin-4-one
PubChem CID139266878
Molecular FormulaC12H9NO
Molecular Weight183.21 g/mol
Exact Mass183.07
IUPAC Name3,5-dihydrocyclopenta[h]quinolin-4-one
SMILESO=C1CC=NC2=C1CC=C1C=CC=C12
InChIInChI=1S/C12H9NO/c14-11-6-7-13-12-9-3-1-2-8(9)4-5-10(11)12/h1-4,7H,5-6H2
InChIKeyWYHGHGUJYFNRPT-UHFFFAOYSA-N
XLogP2.11
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.21
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,5-dihydrocyclopenta[h]quinolin-4-one?
The IUPAC name of 3,5-dihydrocyclopenta[h]quinolin-4-one (CID 139266878) is 3,5-dihydrocyclopenta[h]quinolin-4-one.
What is the SMILES notation for 3,5-dihydrocyclopenta[h]quinolin-4-one?
The canonical SMILES for 3,5-dihydrocyclopenta[h]quinolin-4-one is O=C1CC=NC2=C1CC=C1C=CC=C12.
What is the InChIKey of 3,5-dihydrocyclopenta[h]quinolin-4-one?
The InChIKey is WYHGHGUJYFNRPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9NO/c14-11-6-7-13-12-9-3-1-2-8(9)4-5-10(11)12/h1-4,7H,5-6H2.
What are the key properties of 3,5-dihydrocyclopenta[h]quinolin-4-one?
3,5-dihydrocyclopenta[h]quinolin-4-one has a molecular weight of 183.21 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dihydrocyclopenta[h]quinolin-4-one is sourced from PubChem (CID 139266878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).