5-(1H-indol-4-yl)-1H-pyridin-2-one

C13H10N2O — CID 122200265

IUPAC5-(1H-indol-4-yl)-1H-pyridin-2-one
SMILESO=c1ccc(-c2cccc3[nH]ccc23)c[nH]1
InChIInChI=1S/C13H10N2O/c16-13-5-4-9(8-15-13)10-2-1-3-12-11(10)6-7-14-12/h1-8,14H,(H,15,16)
InChIKeyDZGACHQVDYGPTL-UHFFFAOYSA-N
MW210.24 g/mol
LogP2.52
Rot. Bonds1

About 5-(1H-indol-4-yl)-1H-pyridin-2-one

5-(1H-indol-4-yl)-1H-pyridin-2-one (PubChem CID 122200265) has the molecular formula C13H10N2O and a molecular weight of 210.24 g/mol. Its IUPAC name is 5-(1H-indol-4-yl)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(1H-indol-4-yl)-1H-pyridin-2-one
PubChem CID122200265
Molecular FormulaC13H10N2O
Molecular Weight210.24 g/mol
Exact Mass210.08
IUPAC Name5-(1H-indol-4-yl)-1H-pyridin-2-one
SMILESO=c1ccc(-c2cccc3[nH]ccc23)c[nH]1
InChIInChI=1S/C13H10N2O/c16-13-5-4-9(8-15-13)10-2-1-3-12-11(10)6-7-14-12/h1-8,14H,(H,15,16)
InChIKeyDZGACHQVDYGPTL-UHFFFAOYSA-N
XLogP2.52
TPSA48.65 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.24
LogP ≤ 52.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-methylsulfonylphenyl)-1H-indole
CID 50973001
[3-(1H-indol-4-yl)phenyl]phosphane
CID 142467454
5-(4-methylnaphthalen-1-yl)-1H-pyridin-2-one
CID 53405290
4-(4-ethoxyphenyl)-1H-indole
CID 141124806
4-[3,5-bis(trifluoromethyl)phenyl]-1H-indole
CID 59107889
2-(6-oxo-1H-pyridin-3-yl)benzaldehyde
CID 53217523
5-amino-4-(1H-indol-4-yl)-1,2-dihydropyrazol-3-one
CID 98773093
4-(2,3-dichlorophenyl)-1H-indole
CID 172647420
2-fluoro-5-(1H-indol-4-yl)benzonitrile
CID 22561837
ethane;4-(3-propan-2-ylphenyl)-1H-indole
CID 156726959
1H-indol-4-ol
CID 102220556
5-(1,2,3,4-tetrahydroisoquinolin-5-yl)-1H-pyridin-2-one
CID 56869022

Frequently Asked Questions

What is the IUPAC name of 5-(1H-indol-4-yl)-1H-pyridin-2-one?
The IUPAC name of 5-(1H-indol-4-yl)-1H-pyridin-2-one (CID 122200265) is 5-(1H-indol-4-yl)-1H-pyridin-2-one.
What is the SMILES notation for 5-(1H-indol-4-yl)-1H-pyridin-2-one?
The canonical SMILES for 5-(1H-indol-4-yl)-1H-pyridin-2-one is O=c1ccc(-c2cccc3[nH]ccc23)c[nH]1.
What is the InChIKey of 5-(1H-indol-4-yl)-1H-pyridin-2-one?
The InChIKey is DZGACHQVDYGPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N2O/c16-13-5-4-9(8-15-13)10-2-1-3-12-11(10)6-7-14-12/h1-8,14H,(H,15,16).
What are the key properties of 5-(1H-indol-4-yl)-1H-pyridin-2-one?
5-(1H-indol-4-yl)-1H-pyridin-2-one has a molecular weight of 210.24 g/mol, XLogP of 2.52, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1H-indol-4-yl)-1H-pyridin-2-one is sourced from PubChem (CID 122200265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).