1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide

C21H25N5O3 — CID 5329635

IUPAC1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide
SMILESCC(C)c1[nH]nc2c1C(=O)c1c(NC(=O)CN3CCC(C(N)=O)CC3)cccc1-2
InChIInChI=1S/C21H25N5O3/c1-11(2)18-17-19(25-24-18)13-4-3-5-14(16(13)20(17)28)23-15(27)10-26-8-6-12(7-9-26)21(22)29/h3-5,11-12H,6-10H2,1-2H3,(H2,22,29)(H,23,27)(H,24,25)
InChIKeyIISWHFMSGFZNGY-UHFFFAOYSA-N
MW395.46 g/mol
LogP1.88
Rot. Bonds5

About 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide

1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide (PubChem CID 5329635) has the molecular formula C21H25N5O3 and a molecular weight of 395.46 g/mol. Its IUPAC name is 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide
PubChem CID5329635
Molecular FormulaC21H25N5O3
Molecular Weight395.46 g/mol
Exact Mass395.20
IUPAC Name1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide
SMILESCC(C)c1[nH]nc2c1C(=O)c1c(NC(=O)CN3CCC(C(N)=O)CC3)cccc1-2
InChIInChI=1S/C21H25N5O3/c1-11(2)18-17-19(25-24-18)13-4-3-5-14(16(13)20(17)28)23-15(27)10-26-8-6-12(7-9-26)21(22)29/h3-5,11-12H,6-10H2,1-2H3,(H2,22,29)(H,23,27)(H,24,25)
InChIKeyIISWHFMSGFZNGY-UHFFFAOYSA-N
XLogP1.88
TPSA121.18 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500395.46
LogP ≤ 51.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide 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 5l
CID 5329615
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 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide (CID 5329635) is 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide is CC(C)c1[nH]nc2c1C(=O)c1c(NC(=O)CN3CCC(C(N)=O)CC3)cccc1-2.
What is the InChIKey of 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
The InChIKey is IISWHFMSGFZNGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N5O3/c1-11(2)18-17-19(25-24-18)13-4-3-5-14(16(13)20(17)28)23-15(27)10-26-8-6-12(7-9-26)21(22)29/h3-5,11-12H,6-10H2,1-2H3,(H2,22,29)(H,23,27)(H,24,25).
What are the key properties of 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide?
1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide has a molecular weight of 395.46 g/mol, XLogP of 1.88, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-oxo-2-[(4-oxo-3-propan-2-yl-2H-indeno[1,2-c]pyrazol-5-yl)amino]ethyl]piperidine-4-carboxamide is sourced from PubChem (CID 5329635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).