1H-quinolin-2-one

C9H7NO — CID 6038

IUPAC1H-quinolin-2-one
SMILESO=c1ccc2ccccc2[nH]1
InChIInChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)
InChIKeyLISFMEBWQUVKPJ-UHFFFAOYSA-N
MW145.16 g/mol
LogP1.53
Rot. Bonds

About 1H-quinolin-2-one

1H-quinolin-2-one (PubChem CID 6038) has the molecular formula C9H7NO and a molecular weight of 145.16 g/mol. Its IUPAC name is 1H-quinolin-2-one.

Molecular Properties

Compound Name1H-quinolin-2-one
PubChem CID6038
Molecular FormulaC9H7NO
Molecular Weight145.16 g/mol
Exact Mass145.05
IUPAC Name1H-quinolin-2-one
SMILESO=c1ccc2ccccc2[nH]1
InChIInChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11)
InChIKeyLISFMEBWQUVKPJ-UHFFFAOYSA-N
XLogP1.53
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.16
LogP ≤ 51.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-quinolin-2-one?
The IUPAC name of 1H-quinolin-2-one (CID 6038) is 1H-quinolin-2-one.
What is the SMILES notation for 1H-quinolin-2-one?
The canonical SMILES for 1H-quinolin-2-one is O=c1ccc2ccccc2[nH]1.
What is the InChIKey of 1H-quinolin-2-one?
The InChIKey is LISFMEBWQUVKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO/c11-9-6-5-7-3-1-2-4-8(7)10-9/h1-6H,(H,10,11).
What are the key properties of 1H-quinolin-2-one?
1H-quinolin-2-one has a molecular weight of 145.16 g/mol, XLogP of 1.53, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-quinolin-2-one is sourced from PubChem (CID 6038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).