2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide

C20H16N4O2 — CID 167999942

IUPAC2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide
SMILESO=C1C=CC(c2ccccc2NC(=O)Cc2c[nH]c3ccccc23)N=N1
InChIInChI=1S/C20H16N4O2/c25-19-10-9-18(23-24-19)15-6-2-4-8-17(15)22-20(26)11-13-12-21-16-7-3-1-5-14(13)16/h1-10,12,18,21H,11H2,(H,22,26)
InChIKeyJWHJDPNCUQSHSF-UHFFFAOYSA-N
MW344.37 g/mol
LogP3.94
Rot. Bonds4

About 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide

2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide (PubChem CID 167999942) has the molecular formula C20H16N4O2 and a molecular weight of 344.37 g/mol. Its IUPAC name is 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide
PubChem CID167999942
Molecular FormulaC20H16N4O2
Molecular Weight344.37 g/mol
Exact Mass344.13
IUPAC Name2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide
SMILESO=C1C=CC(c2ccccc2NC(=O)Cc2c[nH]c3ccccc23)N=N1
InChIInChI=1S/C20H16N4O2/c25-19-10-9-18(23-24-19)15-6-2-4-8-17(15)22-20(26)11-13-12-21-16-7-3-1-5-14(13)16/h1-10,12,18,21H,11H2,(H,22,26)
InChIKeyJWHJDPNCUQSHSF-UHFFFAOYSA-N
XLogP3.94
TPSA86.68 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(hydroxymethyl)phenyl]-2-(1H-indol-3-yl)acetamide
CID 60653710
2-(1H-indol-3-yl)-N-(2-oxo-1H-pyridin-3-yl)acetamide
CID 51101093
2-(1H-indol-3-yl)-N-(1H-indol-4-yl)acetamide
CID 110745009
N-(2-chloro-3-pyridinyl)-2-(1H-indol-3-yl)acetamide
CID 10869874
2-(1H-indol-3-yl)-N-[2-(6-oxo-1H-pyridazin-3-yl)phenyl]acetamide
CID 71804974
N-(2,6-difluoro-3-pyridinyl)-2-(1H-indol-3-yl)acetamide
CID 103097670
N-imidazo[1,2-a]pyridin-8-yl-2-(1H-indol-3-yl)acetamide
CID 110745727
N-[6-(2-chloroanilino)pyridazin-3-yl]-2-(1H-indol-3-yl)acetamide
CID 113047370
N-[6-(2-ethylanilino)pyridazin-3-yl]-2-(1H-indol-3-yl)acetamide
CID 113046653
N-hydroxy-2-(1H-indol-3-yl)acetamide
CID 13058633
2-(1H-indol-3-yl)-N-(3-methyl-4-pyridinyl)acetamide
CID 63671729
4-[[2-(1H-indol-3-yl)acetyl]amino]thiophene-3-carboxamide
CID 126852042

Frequently Asked Questions

What is the IUPAC name of 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide?
The IUPAC name of 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide (CID 167999942) is 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide.
What is the SMILES notation for 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide?
The canonical SMILES for 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide is O=C1C=CC(c2ccccc2NC(=O)Cc2c[nH]c3ccccc23)N=N1.
What is the InChIKey of 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide?
The InChIKey is JWHJDPNCUQSHSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2/c25-19-10-9-18(23-24-19)15-6-2-4-8-17(15)22-20(26)11-13-12-21-16-7-3-1-5-14(13)16/h1-10,12,18,21H,11H2,(H,22,26).
What are the key properties of 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide?
2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide has a molecular weight of 344.37 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indol-3-yl)-N-[2-(6-oxo-3H-pyridazin-3-yl)phenyl]acetamide is sourced from PubChem (CID 167999942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).