(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone

C16H17N3O3 — CID 127246249

IUPAC(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone
SMILESCOc1ccccc1C(=O)N1CCOC(c2cnccn2)C1
InChIInChI=1S/C16H17N3O3/c1-21-14-5-3-2-4-12(14)16(20)19-8-9-22-15(11-19)13-10-17-6-7-18-13/h2-7,10,15H,8-9,11H2,1H3
InChIKeyQHXRJJGGIPVOBF-UHFFFAOYSA-N
MW299.33 g/mol
LogP1.70
Rot. Bonds3

About (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone

(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone (PubChem CID 127246249) has the molecular formula C16H17N3O3 and a molecular weight of 299.33 g/mol. Its IUPAC name is (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone
PubChem CID127246249
Molecular FormulaC16H17N3O3
Molecular Weight299.33 g/mol
Exact Mass299.13
IUPAC Name(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone
SMILESCOc1ccccc1C(=O)N1CCOC(c2cnccn2)C1
InChIInChI=1S/C16H17N3O3/c1-21-14-5-3-2-4-12(14)16(20)19-8-9-22-15(11-19)13-10-17-6-7-18-13/h2-7,10,15H,8-9,11H2,1H3
InChIKeyQHXRJJGGIPVOBF-UHFFFAOYSA-N
XLogP1.70
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.33
LogP ≤ 51.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(1-methylindol-3-yl)-[(2S)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124998929
(4-methoxyphenyl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124969089
(2-methoxyphenyl)-[2-(4-methylphenyl)morpholin-4-yl]methanone
CID 110326509
(2,6-difluorophenyl)-[(2S)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124986914
3-phenoxy-1-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]propan-1-one
CID 124947678
(1-propylpyrazol-3-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124955626
(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[(2R)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124973919
(3,6-dimethyl-[1,2]oxazolo[5,4-b]pyridin-4-yl)-[(2S)-2-pyrazin-2-ylmorpholin-4-yl]methanone
CID 124973918
(2-pyrazin-2-ylmorpholin-4-yl)-quinolin-6-ylmethanone
CID 110103222
N'-hydroxy-4-(2-methoxybenzoyl)morpholine-2-carboximidamide
CID 79680362
[(2R)-2-pyrazin-2-ylmorpholin-4-yl]-(1,3-thiazol-4-yl)methanone
CID 125022410
[2-[5-(methylamino)-2-pyridinyl]morpholin-4-yl]-pyrazin-2-ylmethanone
CID 110271985

Frequently Asked Questions

What is the IUPAC name of (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone?
The IUPAC name of (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone (CID 127246249) is (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone.
What is the SMILES notation for (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone?
The canonical SMILES for (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone is COc1ccccc1C(=O)N1CCOC(c2cnccn2)C1.
What is the InChIKey of (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone?
The InChIKey is QHXRJJGGIPVOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O3/c1-21-14-5-3-2-4-12(14)16(20)19-8-9-22-15(11-19)13-10-17-6-7-18-13/h2-7,10,15H,8-9,11H2,1H3.
What are the key properties of (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone?
(2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone has a molecular weight of 299.33 g/mol, XLogP of 1.70, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methoxyphenyl)-(2-pyrazin-2-ylmorpholin-4-yl)methanone is sourced from PubChem (CID 127246249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).