6H-quinolin-7-one

C9H7NO — CID 66583170

IUPAC6H-quinolin-7-one
SMILESO=C1C=c2ncccc2=CC1
InChIInChI=1S/C9H7NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h1-3,5-6H,4H2
InChIKeyFGIPTIIDEIFDQO-UHFFFAOYSA-N
MW145.16 g/mol
LogP-0.38
Rot. Bonds

About 6H-quinolin-7-one

6H-quinolin-7-one (PubChem CID 66583170) has the molecular formula C9H7NO and a molecular weight of 145.16 g/mol. Its IUPAC name is 6H-quinolin-7-one.

Molecular Properties

Compound Name6H-quinolin-7-one
PubChem CID66583170
Molecular FormulaC9H7NO
Molecular Weight145.16 g/mol
Exact Mass145.05
IUPAC Name6H-quinolin-7-one
SMILESO=C1C=c2ncccc2=CC1
InChIInChI=1S/C9H7NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h1-3,5-6H,4H2
InChIKeyFGIPTIIDEIFDQO-UHFFFAOYSA-N
XLogP-0.38
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 5-0.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6H-quinolin-7-one?
The IUPAC name of 6H-quinolin-7-one (CID 66583170) is 6H-quinolin-7-one.
What is the SMILES notation for 6H-quinolin-7-one?
The canonical SMILES for 6H-quinolin-7-one is O=C1C=c2ncccc2=CC1.
What is the InChIKey of 6H-quinolin-7-one?
The InChIKey is FGIPTIIDEIFDQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO/c11-8-4-3-7-2-1-5-10-9(7)6-8/h1-3,5-6H,4H2.
What are the key properties of 6H-quinolin-7-one?
6H-quinolin-7-one has a molecular weight of 145.16 g/mol, XLogP of -0.38, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6H-quinolin-7-one is sourced from PubChem (CID 66583170), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).