(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone

C17H28N6O2 — CID 109277598

IUPAC(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone
SMILESCCN1CCN(C(=O)c2cnc(NCCN3CCOCC3)cn2)CC1
InChIInChI=1S/C17H28N6O2/c1-2-21-5-7-23(8-6-21)17(24)15-13-20-16(14-19-15)18-3-4-22-9-11-25-12-10-22/h13-14H,2-12H2,1H3,(H,18,20)
InChIKeyZGHJSWKBCRENQE-UHFFFAOYSA-N
MW348.45 g/mol
LogP-0.00
Rot. Bonds6

About (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone

(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone (PubChem CID 109277598) has the molecular formula C17H28N6O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone
PubChem CID109277598
Molecular FormulaC17H28N6O2
Molecular Weight348.45 g/mol
Exact Mass348.23
IUPAC Name(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone
SMILESCCN1CCN(C(=O)c2cnc(NCCN3CCOCC3)cn2)CC1
InChIInChI=1S/C17H28N6O2/c1-2-21-5-7-23(8-6-21)17(24)15-13-20-16(14-19-15)18-3-4-22-9-11-25-12-10-22/h13-14H,2-12H2,1H3,(H,18,20)
InChIKeyZGHJSWKBCRENQE-UHFFFAOYSA-N
XLogP-0.00
TPSA73.83 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Morphazinamide
CID 70374
Lcb-2183
CID 135418284
N-cycloheptyl-5-(piperidin-1-yl)pyrazine-2-carboxamide
CID 44438597
[1-(5-Carbamoylpyrazin-2-yl)piperidin-4-yl] 4-propan-2-ylpiperazine-1-carboxylate
CID 89487731
N-[3-(morpholin-4-yl)propyl]pyrazine-2-carboxamide
CID 5005675
6-((2-Hydroxyethyl)amino)-1,3-dimethyl-2,4(1H,3H)-pteridinedione
CID 375734
1-(Oxolan-3-yl)pteridine-2,4-dione
CID 44382641
5-Cyano-6-morpholinopyrazine-2-carboxamide
CID 53317734
9-[6-(Piperidin-1-ylcarbonyl)pyrazin-2-yl]-1,4,9-triazaspiro[5.5]undecan-5-one
CID 56758988
3-[6-(Pyrrolidin-1-ylcarbonyl)pyrazin-2-yl]-3,9-diazaspiro[5.5]undecane
CID 56879099
(3S*,4R*)-N,N-dimethyl-1-[6-(4-morpholinylcarbonyl)-2-pyrazinyl]-4-propyl-3-pyrrolidinamine
CID 70710281
N-[(3R*,4R*)-3-hydroxy-1-(3-methylpyrazin-2-yl)piperidin-4-yl]pyrazine-2-carboxamide
CID 70783063

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone?
The IUPAC name of (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone (CID 109277598) is (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone.
What is the SMILES notation for (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone?
The canonical SMILES for (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone is CCN1CCN(C(=O)c2cnc(NCCN3CCOCC3)cn2)CC1.
What is the InChIKey of (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone?
The InChIKey is ZGHJSWKBCRENQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N6O2/c1-2-21-5-7-23(8-6-21)17(24)15-13-20-16(14-19-15)18-3-4-22-9-11-25-12-10-22/h13-14H,2-12H2,1H3,(H,18,20).
What are the key properties of (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone?
(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone has a molecular weight of 348.45 g/mol, XLogP of -0.00, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone is sourced from PubChem (CID 109277598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).