cyclopenta[g]quinolin-4-one

C12H7NO — CID 91460699

IUPACcyclopenta[g]quinolin-4-one
SMILESO=C1C=CN=c2cc3c(cc21)=CC=C3
InChIInChI=1S/C12H7NO/c14-12-4-5-13-11-7-9-3-1-2-8(9)6-10(11)12/h1-7H
InChIKeyGJJUATMIIXZGGV-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.82
Rot. Bonds

About cyclopenta[g]quinolin-4-one

cyclopenta[g]quinolin-4-one (PubChem CID 91460699) has the molecular formula C12H7NO and a molecular weight of 181.19 g/mol. Its IUPAC name is cyclopenta[g]quinolin-4-one.

Molecular Properties

Compound Namecyclopenta[g]quinolin-4-one
PubChem CID91460699
Molecular FormulaC12H7NO
Molecular Weight181.19 g/mol
Exact Mass181.05
IUPAC Namecyclopenta[g]quinolin-4-one
SMILESO=C1C=CN=c2cc3c(cc21)=CC=C3
InChIInChI=1S/C12H7NO/c14-12-4-5-13-11-7-9-3-1-2-8(9)6-10(11)12/h1-7H
InChIKeyGJJUATMIIXZGGV-UHFFFAOYSA-N
XLogP0.82
TPSA29.43 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.19
LogP ≤ 50.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclopenta[g]quinolin-4-one?
The IUPAC name of cyclopenta[g]quinolin-4-one (CID 91460699) is cyclopenta[g]quinolin-4-one.
What is the SMILES notation for cyclopenta[g]quinolin-4-one?
The canonical SMILES for cyclopenta[g]quinolin-4-one is O=C1C=CN=c2cc3c(cc21)=CC=C3.
What is the InChIKey of cyclopenta[g]quinolin-4-one?
The InChIKey is GJJUATMIIXZGGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7NO/c14-12-4-5-13-11-7-9-3-1-2-8(9)6-10(11)12/h1-7H.
What are the key properties of cyclopenta[g]quinolin-4-one?
cyclopenta[g]quinolin-4-one has a molecular weight of 181.19 g/mol, XLogP of 0.82, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopenta[g]quinolin-4-one is sourced from PubChem (CID 91460699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).