indeno[2,1-b]pyridin-4-one

C12H7NO — CID 141121462

IUPACindeno[2,1-b]pyridin-4-one
SMILESO=C1C=CN=C2C=c3ccccc3=C12
InChIInChI=1S/C12H7NO/c14-11-5-6-13-10-7-8-3-1-2-4-9(8)12(10)11/h1-7H
InChIKeyLEUDAKDAUPMMFH-UHFFFAOYSA-N
MW181.19 g/mol
LogP0.17
Rot. Bonds

About indeno[2,1-b]pyridin-4-one

indeno[2,1-b]pyridin-4-one (PubChem CID 141121462) has the molecular formula C12H7NO and a molecular weight of 181.19 g/mol. Its IUPAC name is indeno[2,1-b]pyridin-4-one.

Molecular Properties

Compound Nameindeno[2,1-b]pyridin-4-one
PubChem CID141121462
Molecular FormulaC12H7NO
Molecular Weight181.19 g/mol
Exact Mass181.05
IUPAC Nameindeno[2,1-b]pyridin-4-one
SMILESO=C1C=CN=C2C=c3ccccc3=C12
InChIInChI=1S/C12H7NO/c14-11-5-6-13-10-7-8-3-1-2-4-9(8)12(10)11/h1-7H
InChIKeyLEUDAKDAUPMMFH-UHFFFAOYSA-N
XLogP0.17
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 ≤ 50.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of indeno[2,1-b]pyridin-4-one?
The IUPAC name of indeno[2,1-b]pyridin-4-one (CID 141121462) is indeno[2,1-b]pyridin-4-one.
What is the SMILES notation for indeno[2,1-b]pyridin-4-one?
The canonical SMILES for indeno[2,1-b]pyridin-4-one is O=C1C=CN=C2C=c3ccccc3=C12.
What is the InChIKey of indeno[2,1-b]pyridin-4-one?
The InChIKey is LEUDAKDAUPMMFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7NO/c14-11-5-6-13-10-7-8-3-1-2-4-9(8)12(10)11/h1-7H.
What are the key properties of indeno[2,1-b]pyridin-4-one?
indeno[2,1-b]pyridin-4-one has a molecular weight of 181.19 g/mol, XLogP of 0.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for indeno[2,1-b]pyridin-4-one is sourced from PubChem (CID 141121462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).