[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone

C16H18N4O2 — CID 110132191

IUPAC[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCOCC1CCc1cnccn1
InChIInChI=1S/C16H18N4O2/c21-16(15-3-1-2-6-19-15)20-9-10-22-12-14(20)5-4-13-11-17-7-8-18-13/h1-3,6-8,11,14H,4-5,9-10,12H2
InChIKeyHAQIDAZQISLDOK-UHFFFAOYSA-N
MW298.35 g/mol
LogP1.35
Rot. Bonds4

About [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone

[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone (PubChem CID 110132191) has the molecular formula C16H18N4O2 and a molecular weight of 298.35 g/mol. Its IUPAC name is [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone.

Molecular Properties

Compound Name[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone
PubChem CID110132191
Molecular FormulaC16H18N4O2
Molecular Weight298.35 g/mol
Exact Mass298.14
IUPAC Name[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone
SMILESO=C(c1ccccn1)N1CCOCC1CCc1cnccn1
InChIInChI=1S/C16H18N4O2/c21-16(15-3-1-2-6-19-15)20-9-10-22-12-14(20)5-4-13-11-17-7-8-18-13/h1-3,6-8,11,14H,4-5,9-10,12H2
InChIKeyHAQIDAZQISLDOK-UHFFFAOYSA-N
XLogP1.35
TPSA68.21 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.35
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyrimidin-2-ylmethanone
CID 110132170
[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-thiophen-2-ylmethanone
CID 124995063
(1-methylpyrrol-2-yl)-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]methanone
CID 125013670
3-phenyl-1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]propan-1-one
CID 124940868
[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyrazolo[1,5-a]pyrimidin-3-ylmethanone
CID 124977212
1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-2-thiophen-3-ylethanone
CID 124959044
2-(4-methoxyphenoxy)-1-[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone
CID 110132201
3-(4-chlorophenyl)-1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]propan-1-one
CID 124944351
[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 125018147
[4-(methoxymethyl)-5-methyl-1,2-oxazol-3-yl]-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]methanone
CID 125010537
4-imidazol-1-yl-1-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]butan-1-one
CID 124998191
1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone
CID 124998042

Frequently Asked Questions

What is the IUPAC name of [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone?
The IUPAC name of [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone (CID 110132191) is [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone.
What is the SMILES notation for [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone?
The canonical SMILES for [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone is O=C(c1ccccn1)N1CCOCC1CCc1cnccn1.
What is the InChIKey of [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone?
The InChIKey is HAQIDAZQISLDOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O2/c21-16(15-3-1-2-6-19-15)20-9-10-22-12-14(20)5-4-13-11-17-7-8-18-13/h1-3,6-8,11,14H,4-5,9-10,12H2.
What are the key properties of [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone?
[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone has a molecular weight of 298.35 g/mol, XLogP of 1.35, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone is sourced from PubChem (CID 110132191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).