tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate

C15H28N4O3 — CID 103397888

IUPACtert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
SMILESCC(C)(C)OC(=O)N1CCN=C(NCCN2CCOCC2)C1
InChIInChI=1S/C15H28N4O3/c1-15(2,3)22-14(20)19-7-5-17-13(12-19)16-4-6-18-8-10-21-11-9-18/h4-12H2,1-3H3,(H,16,17)
InChIKeyLFCQGGBUVCKUJS-UHFFFAOYSA-N
MW312.41 g/mol
LogP0.56
Rot. Bonds3

About tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate

tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate (PubChem CID 103397888) has the molecular formula C15H28N4O3 and a molecular weight of 312.41 g/mol. Its IUPAC name is tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate.

Molecular Properties

Compound Nametert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
PubChem CID103397888
Molecular FormulaC15H28N4O3
Molecular Weight312.41 g/mol
Exact Mass312.22
IUPAC Nametert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
SMILESCC(C)(C)OC(=O)N1CCN=C(NCCN2CCOCC2)C1
InChIInChI=1S/C15H28N4O3/c1-15(2,3)22-14(20)19-7-5-17-13(12-19)16-4-6-18-8-10-21-11-9-18/h4-12H2,1-3H3,(H,16,17)
InChIKeyLFCQGGBUVCKUJS-UHFFFAOYSA-N
XLogP0.56
TPSA66.40 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.41
LogP ≤ 50.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

Tert-butyl 5-(methylamino)-1,2,3,6-tetrahydropyrazine-1-carboxylate hydrochloride
CID 165910008
tert-butyl 6-[2-(2,2,2-trifluoroethoxy)ethylamino]-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103398165
tert-butyl 6-[2-(2,2-difluoroethoxy)ethylamino]-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 105912977
Tert-butyl 5-(methylamino)-1,2,3,6-tetrahydropyrazine-1-carboxylate
CID 136762902
[2-Amino-2-[(2-methylpropan-2-yl)oxyimino]ethyl] piperazine-1-carboxylate
CID 123837521
Tert-butyl 4-(6-methyl-1,4-dihydro-1,3,5-triazin-2-yl)piperazine-1-carboxylate
CID 144105368
tert-butyl 6-(2-methoxyethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397848
tert-butyl 6-[2-(dimethylamino)ethylamino]-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397855
tert-butyl 6-[2-(diethylamino)ethylamino]-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397860
tert-butyl 6-(1-methoxypropan-2-ylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397867
tert-butyl 6-(3-ethoxypropylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397893
tert-butyl 6-(2-hydroxyethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate
CID 103397897

Frequently Asked Questions

What is the IUPAC name of tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate?
The IUPAC name of tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate (CID 103397888) is tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate.
What is the SMILES notation for tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate?
The canonical SMILES for tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate is CC(C)(C)OC(=O)N1CCN=C(NCCN2CCOCC2)C1.
What is the InChIKey of tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate?
The InChIKey is LFCQGGBUVCKUJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N4O3/c1-15(2,3)22-14(20)19-7-5-17-13(12-19)16-4-6-18-8-10-21-11-9-18/h4-12H2,1-3H3,(H,16,17).
What are the key properties of tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate?
tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate has a molecular weight of 312.41 g/mol, XLogP of 0.56, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl 6-(2-morpholin-4-ylethylamino)-3,5-dihydro-2H-pyrazine-4-carboxylate is sourced from PubChem (CID 103397888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).