(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone

C15H19N5O2 — CID 124955626

IUPAC(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
SMILESCCCn1ccc(C(=O)N2CCO[C@@H](c3cnccn3)C2)n1
InChIInChI=1S/C15H19N5O2/c1-2-6-20-7-3-12(18-20)15(21)19-8-9-22-14(11-19)13-10-16-4-5-17-13/h3-5,7,10,14H,2,6,8-9,11H2,1H3/t14-/m1/s1
InChIKeyFLGIFHGNXVSMAZ-CQSZACIVSA-N
MW301.35 g/mol
LogP1.30
Rot. Bonds4

About (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone

(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone (PubChem CID 124955626) has the molecular formula C15H19N5O2 and a molecular weight of 301.35 g/mol. Its IUPAC name is (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
PubChem CID124955626
Molecular FormulaC15H19N5O2
Molecular Weight301.35 g/mol
Exact Mass301.15
IUPAC Name(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
SMILESCCCn1ccc(C(=O)N2CCO[C@@H](c3cnccn3)C2)n1
InChIInChI=1S/C15H19N5O2/c1-2-6-20-7-3-12(18-20)15(21)19-8-9-22-14(11-19)13-10-16-4-5-17-13/h3-5,7,10,14H,2,6,8-9,11H2,1H3/t14-/m1/s1
InChIKeyFLGIFHGNXVSMAZ-CQSZACIVSA-N
XLogP1.30
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.35
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone?
The IUPAC name of (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone (CID 124955626) is (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone.
What is the SMILES notation for (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone?
The canonical SMILES for (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone is CCCn1ccc(C(=O)N2CCO[C@@H](c3cnccn3)C2)n1.
What is the InChIKey of (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone?
The InChIKey is FLGIFHGNXVSMAZ-CQSZACIVSA-N. The full InChI is InChI=1S/C15H19N5O2/c1-2-6-20-7-3-12(18-20)15(21)19-8-9-22-14(11-19)13-10-16-4-5-17-13/h3-5,7,10,14H,2,6,8-9,11H2,1H3/t14-/m1/s1.
What are the key properties of (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone?
(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone has a molecular weight of 301.35 g/mol, XLogP of 1.30, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone is sourced from PubChem (CID 124955626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).