N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide

C18H13N3O2 — CID 5329604

IUPACN-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide
SMILESCC(=O)Nc1cccc2c1C(=O)c1c(-c3ccccc3)n[nH]c1-2
InChIInChI=1S/C18H13N3O2/c1-10(22)19-13-9-5-8-12-14(13)18(23)15-16(20-21-17(12)15)11-6-3-2-4-7-11/h2-9H,1H3,(H,19,22)(H,20,21)
InChIKeyFMWUPJJFWGHUDQ-UHFFFAOYSA-N
MW303.32 g/mol
LogP3.25
Rot. Bonds2

About N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide

N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide (PubChem CID 5329604) has the molecular formula C18H13N3O2 and a molecular weight of 303.32 g/mol. Its IUPAC name is N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide.

Molecular Properties

Compound NameN-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide
PubChem CID5329604
Molecular FormulaC18H13N3O2
Molecular Weight303.32 g/mol
Exact Mass303.10
IUPAC NameN-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide
SMILESCC(=O)Nc1cccc2c1C(=O)c1c(-c3ccccc3)n[nH]c1-2
InChIInChI=1S/C18H13N3O2/c1-10(22)19-13-9-5-8-12-14(13)18(23)15-16(20-21-17(12)15)11-6-3-2-4-7-11/h2-9H,1H3,(H,19,22)(H,20,21)
InChIKeyFMWUPJJFWGHUDQ-UHFFFAOYSA-N
XLogP3.25
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.32
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-(Aminomethyl)piperidin-1-YL)-N-(3_cyclohexyl-4-oxo-2,4-dihydroindeno[1,2-C]pyrazol-5-YL)acetamide
CID 5288017
Indenopyrazole 5c
CID 5329606
Indenopyrazole 5d
CID 5329607
Indenopyrazole 5j
CID 5329613
Indenopyrazole 5k
CID 5329614
Indenopyrazole 5l
CID 5329615
Indenopyrazole 5m
CID 5329616
Indenopyrazole 8a
CID 5329617
Indenopyrazole 8b
CID 5329618
Indenopyrazole 8c
CID 5329619
Indenopyrazole 8d
CID 5329620
Indenopyrazole 8e
CID 5329621

Frequently Asked Questions

What is the IUPAC name of N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide?
The IUPAC name of N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide (CID 5329604) is N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide.
What is the SMILES notation for N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide?
The canonical SMILES for N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide is CC(=O)Nc1cccc2c1C(=O)c1c(-c3ccccc3)n[nH]c1-2.
What is the InChIKey of N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide?
The InChIKey is FMWUPJJFWGHUDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N3O2/c1-10(22)19-13-9-5-8-12-14(13)18(23)15-16(20-21-17(12)15)11-6-3-2-4-7-11/h2-9H,1H3,(H,19,22)(H,20,21).
What are the key properties of N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide?
N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide has a molecular weight of 303.32 g/mol, XLogP of 3.25, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-oxo-3-phenyl-1H-indeno[2,1-d]pyrazol-5-yl)acetamide is sourced from PubChem (CID 5329604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).