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

C22H20N4O3 — CID 5329615

IUPACN-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide
SMILESCC(=O)Nc1cccc2c1C(=O)c1c(-c3ccc(N4CCOCC4)cc3)n[nH]c1-2
InChIInChI=1S/C22H20N4O3/c1-13(27)23-17-4-2-3-16-18(17)22(28)19-20(24-25-21(16)19)14-5-7-15(8-6-14)26-9-11-29-12-10-26/h2-8H,9-12H2,1H3,(H,23,27)(H,24,25)
InChIKeyYUPJUWXUIUHQKD-UHFFFAOYSA-N
MW388.43 g/mol
LogP3.08
Rot. Bonds3

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

N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide (PubChem CID 5329615) has the molecular formula C22H20N4O3 and a molecular weight of 388.43 g/mol. Its IUPAC name is N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide.

Molecular Properties

Compound NameN-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide
PubChem CID5329615
Molecular FormulaC22H20N4O3
Molecular Weight388.43 g/mol
Exact Mass388.15
IUPAC NameN-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide
SMILESCC(=O)Nc1cccc2c1C(=O)c1c(-c3ccc(N4CCOCC4)cc3)n[nH]c1-2
InChIInChI=1S/C22H20N4O3/c1-13(27)23-17-4-2-3-16-18(17)22(28)19-20(24-25-21(16)19)14-5-7-15(8-6-14)26-9-11-29-12-10-26/h2-8H,9-12H2,1H3,(H,23,27)(H,24,25)
InChIKeyYUPJUWXUIUHQKD-UHFFFAOYSA-N
XLogP3.08
TPSA87.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.43
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide with MolForge

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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 5a
CID 5329604
Indenopyrazole 5c
CID 5329606
Indenopyrazole 5d
CID 5329607
Indenopyrazole 5j
CID 5329613
Indenopyrazole 5k
CID 5329614
Indenopyrazole 8a
CID 5329617
Indenopyrazole 8b
CID 5329618
Indenopyrazole 8c
CID 5329619
Indenopyrazole 8d
CID 5329620
Indenopyrazole 8e
CID 5329621
Indenopyrazole 8f
CID 5329622

Frequently Asked Questions

What is the IUPAC name of N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide?
The IUPAC name of N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide (CID 5329615) is N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide.
What is the SMILES notation for N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide?
The canonical SMILES for N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide is CC(=O)Nc1cccc2c1C(=O)c1c(-c3ccc(N4CCOCC4)cc3)n[nH]c1-2.
What is the InChIKey of N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide?
The InChIKey is YUPJUWXUIUHQKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20N4O3/c1-13(27)23-17-4-2-3-16-18(17)22(28)19-20(24-25-21(16)19)14-5-7-15(8-6-14)26-9-11-29-12-10-26/h2-8H,9-12H2,1H3,(H,23,27)(H,24,25).
What are the key properties of N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide?
N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide has a molecular weight of 388.43 g/mol, XLogP of 3.08, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(4-morpholin-4-ylphenyl)-4-oxo-1H-indeno[2,1-d]pyrazol-5-yl]acetamide is sourced from PubChem (CID 5329615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).