(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

C13H22N4O2 — CID 104515903

IUPAC(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCOc1nccnc1C(N)C1CN(C(C)C)CCO1
InChIInChI=1S/C13H22N4O2/c1-9(2)17-6-7-19-10(8-17)11(14)12-13(18-3)16-5-4-15-12/h4-5,9-11H,6-8,14H2,1-3H3
InChIKeyUDDGUOADJMEJNS-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.59
Rot. Bonds4

About (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine

(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (PubChem CID 104515903) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.

Molecular Properties

Compound Name(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
PubChem CID104515903
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC Name(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine
SMILESCOc1nccnc1C(N)C1CN(C(C)C)CCO1
InChIInChI=1S/C13H22N4O2/c1-9(2)17-6-7-19-10(8-17)11(14)12-13(18-3)16-5-4-15-12/h4-5,9-11H,6-8,14H2,1-3H3
InChIKeyUDDGUOADJMEJNS-UHFFFAOYSA-N
XLogP0.59
TPSA73.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The IUPAC name of (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine (CID 104515903) is (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine.
What is the SMILES notation for (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The canonical SMILES for (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is COc1nccnc1C(N)C1CN(C(C)C)CCO1.
What is the InChIKey of (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
The InChIKey is UDDGUOADJMEJNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-9(2)17-6-7-19-10(8-17)11(14)12-13(18-3)16-5-4-15-12/h4-5,9-11H,6-8,14H2,1-3H3.
What are the key properties of (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine?
(3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine has a molecular weight of 266.34 g/mol, XLogP of 0.59, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrazin-2-yl)-(4-propan-2-ylmorpholin-2-yl)methanamine is sourced from PubChem (CID 104515903), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).