(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

C17H28N4O2 — CID 53193449

IUPAC(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESCCn1nccc1C(=O)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C17H28N4O2/c1-2-21-16(6-8-18-21)17(22)20-9-4-3-5-15(20)7-10-19-11-13-23-14-12-19/h6,8,15H,2-5,7,9-14H2,1H3
InChIKeyWRSBZZQSFSCLFM-UHFFFAOYSA-N
MW320.44 g/mol
LogP1.62
Rot. Bonds5

About (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone

(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (PubChem CID 53193449) has the molecular formula C17H28N4O2 and a molecular weight of 320.44 g/mol. Its IUPAC name is (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
PubChem CID53193449
Molecular FormulaC17H28N4O2
Molecular Weight320.44 g/mol
Exact Mass320.22
IUPAC Name(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone
SMILESCCn1nccc1C(=O)N1CCCCC1CCN1CCOCC1
InChIInChI=1S/C17H28N4O2/c1-2-21-16(6-8-18-21)17(22)20-9-4-3-5-15(20)7-10-19-11-13-23-14-12-19/h6,8,15H,2-5,7,9-14H2,1H3
InChIKeyWRSBZZQSFSCLFM-UHFFFAOYSA-N
XLogP1.62
TPSA50.60 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.44
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The IUPAC name of (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone (CID 53193449) is (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The canonical SMILES for (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is CCn1nccc1C(=O)N1CCCCC1CCN1CCOCC1.
What is the InChIKey of (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
The InChIKey is WRSBZZQSFSCLFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N4O2/c1-2-21-16(6-8-18-21)17(22)20-9-4-3-5-15(20)7-10-19-11-13-23-14-12-19/h6,8,15H,2-5,7,9-14H2,1H3.
What are the key properties of (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone?
(2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone has a molecular weight of 320.44 g/mol, XLogP of 1.62, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylpyrazol-3-yl)-[2-(2-morpholin-4-ylethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 53193449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).