5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine

C19H38N4O — CID 144824938

IUPAC5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine
SMILESC1COCCN1.CC.CCCN(CC)c1cnc(C(C)CC)cn1
InChIInChI=1S/C13H23N3.C4H9NO.C2H6/c1-5-8-16(7-3)13-10-14-12(9-15-13)11(4)6-2;1-3-6-4-2-5-1;1-2/h9-11H,5-8H2,1-4H3;5H,1-4H2;1-2H3
InChIKeyFMZQACNKQDIWJP-UHFFFAOYSA-N
MW338.54 g/mol
LogP3.86
Rot. Bonds6

About 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine

5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine (PubChem CID 144824938) has the molecular formula C19H38N4O and a molecular weight of 338.54 g/mol. Its IUPAC name is 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine.

Molecular Properties

Compound Name5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine
PubChem CID144824938
Molecular FormulaC19H38N4O
Molecular Weight338.54 g/mol
Exact Mass338.30
IUPAC Name5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine
SMILESC1COCCN1.CC.CCCN(CC)c1cnc(C(C)CC)cn1
InChIInChI=1S/C13H23N3.C4H9NO.C2H6/c1-5-8-16(7-3)13-10-14-12(9-15-13)11(4)6-2;1-3-6-4-2-5-1;1-2/h9-11H,5-8H2,1-4H3;5H,1-4H2;1-2H3
InChIKeyFMZQACNKQDIWJP-UHFFFAOYSA-N
XLogP3.86
TPSA50.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.54
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine?
The IUPAC name of 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine (CID 144824938) is 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine.
What is the SMILES notation for 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine?
The canonical SMILES for 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine is C1COCCN1.CC.CCCN(CC)c1cnc(C(C)CC)cn1.
What is the InChIKey of 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine?
The InChIKey is FMZQACNKQDIWJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3.C4H9NO.C2H6/c1-5-8-16(7-3)13-10-14-12(9-15-13)11(4)6-2;1-3-6-4-2-5-1;1-2/h9-11H,5-8H2,1-4H3;5H,1-4H2;1-2H3.
What are the key properties of 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine?
5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine has a molecular weight of 338.54 g/mol, XLogP of 3.86, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-N-ethyl-N-propylpyrazin-2-amine;ethane;morpholine is sourced from PubChem (CID 144824938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).