1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone

C17H26N4O2 — CID 124998042

IUPAC1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone
SMILESO=C(CN1CCOC[C@@H]1CCc1cnccn1)N1CCCCC1
InChIInChI=1S/C17H26N4O2/c22-17(20-8-2-1-3-9-20)13-21-10-11-23-14-16(21)5-4-15-12-18-6-7-19-15/h6-7,12,16H,1-5,8-11,13-14H2/t16-/m0/s1
InChIKeyRESWUVPZBDMJKJ-INIZCTEOSA-N
MW318.42 g/mol
LogP1.12
Rot. Bonds5

About 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone

1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone (PubChem CID 124998042) has the molecular formula C17H26N4O2 and a molecular weight of 318.42 g/mol. Its IUPAC name is 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone.

Molecular Properties

Compound Name1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone
PubChem CID124998042
Molecular FormulaC17H26N4O2
Molecular Weight318.42 g/mol
Exact Mass318.21
IUPAC Name1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone
SMILESO=C(CN1CCOC[C@@H]1CCc1cnccn1)N1CCCCC1
InChIInChI=1S/C17H26N4O2/c22-17(20-8-2-1-3-9-20)13-21-10-11-23-14-16(21)5-4-15-12-18-6-7-19-15/h6-7,12,16H,1-5,8-11,13-14H2/t16-/m0/s1
InChIKeyRESWUVPZBDMJKJ-INIZCTEOSA-N
XLogP1.12
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.42
LogP ≤ 51.12
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
3-phenyl-1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]propan-1-one
CID 124940868
1-morpholin-4-yl-2-[(2R)-2-(2-pyridin-2-ylethyl)piperidin-1-yl]ethanone
CID 124844881
[3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-pyridin-2-ylmethanone
CID 110132191
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
1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-2-thiophen-3-ylethanone
CID 124959044
4-imidazol-1-yl-1-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]butan-1-one
CID 124998191
[(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-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(3R)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]propan-1-one
CID 124947820
[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanone
CID 125018147

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone?
The IUPAC name of 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone (CID 124998042) is 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone.
What is the SMILES notation for 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone?
The canonical SMILES for 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone is O=C(CN1CCOC[C@@H]1CCc1cnccn1)N1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone?
The InChIKey is RESWUVPZBDMJKJ-INIZCTEOSA-N. The full InChI is InChI=1S/C17H26N4O2/c22-17(20-8-2-1-3-9-20)13-21-10-11-23-14-16(21)5-4-15-12-18-6-7-19-15/h6-7,12,16H,1-5,8-11,13-14H2/t16-/m0/s1.
What are the key properties of 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone?
1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone has a molecular weight of 318.42 g/mol, XLogP of 1.12, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-2-[(3S)-3-(2-pyrazin-2-ylethyl)morpholin-4-yl]ethanone is sourced from PubChem (CID 124998042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).