(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone

C17H22N6O3 — CID 91914182

IUPAC(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone
SMILESCn1nccc1C(=O)N1CCC(Oc2nccnc2N2CCOCC2)C1
InChIInChI=1S/C17H22N6O3/c1-21-14(2-4-20-21)17(24)23-7-3-13(12-23)26-16-15(18-5-6-19-16)22-8-10-25-11-9-22/h2,4-6,13H,3,7-12H2,1H3
InChIKeyCRPLPAPJFYLAPY-UHFFFAOYSA-N
MW358.40 g/mol
LogP0.34
Rot. Bonds4

About (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone

(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone (PubChem CID 91914182) has the molecular formula C17H22N6O3 and a molecular weight of 358.40 g/mol. Its IUPAC name is (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone.

Molecular Properties

Compound Name(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone
PubChem CID91914182
Molecular FormulaC17H22N6O3
Molecular Weight358.40 g/mol
Exact Mass358.18
IUPAC Name(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone
SMILESCn1nccc1C(=O)N1CCC(Oc2nccnc2N2CCOCC2)C1
InChIInChI=1S/C17H22N6O3/c1-21-14(2-4-20-21)17(24)23-7-3-13(12-23)26-16-15(18-5-6-19-16)22-8-10-25-11-9-22/h2,4-6,13H,3,7-12H2,1H3
InChIKeyCRPLPAPJFYLAPY-UHFFFAOYSA-N
XLogP0.34
TPSA85.61 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.40
LogP ≤ 50.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-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-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone?
The IUPAC name of (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone (CID 91914182) is (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone.
What is the SMILES notation for (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone?
The canonical SMILES for (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone is Cn1nccc1C(=O)N1CCC(Oc2nccnc2N2CCOCC2)C1.
What is the InChIKey of (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone?
The InChIKey is CRPLPAPJFYLAPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N6O3/c1-21-14(2-4-20-21)17(24)23-7-3-13(12-23)26-16-15(18-5-6-19-16)22-8-10-25-11-9-22/h2,4-6,13H,3,7-12H2,1H3.
What are the key properties of (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone?
(2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone has a molecular weight of 358.40 g/mol, XLogP of 0.34, 4 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methylpyrazol-3-yl)-[3-(3-morpholin-4-ylpyrazin-2-yl)oxypyrrolidin-1-yl]methanone is sourced from PubChem (CID 91914182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).