1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine

C12H19N3O2 — CID 105031831

IUPAC1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
SMILESCNC(c1nccnc1OC)C1CCC(C)O1
InChIInChI=1S/C12H19N3O2/c1-8-4-5-9(17-8)10(13-2)11-12(16-3)15-7-6-14-11/h6-10,13H,4-5H2,1-3H3
InChIKeyNXTGRMUWHOPPPL-UHFFFAOYSA-N
MW237.30 g/mol
LogP1.31
Rot. Bonds4

About 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine

1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine (PubChem CID 105031831) has the molecular formula C12H19N3O2 and a molecular weight of 237.30 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
PubChem CID105031831
Molecular FormulaC12H19N3O2
Molecular Weight237.30 g/mol
Exact Mass237.15
IUPAC Name1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
SMILESCNC(c1nccnc1OC)C1CCC(C)O1
InChIInChI=1S/C12H19N3O2/c1-8-4-5-9(17-8)10(13-2)11-12(16-3)15-7-6-14-11/h6-10,13H,4-5H2,1-3H3
InChIKeyNXTGRMUWHOPPPL-UHFFFAOYSA-N
XLogP1.31
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(3-methoxypyrazin-2-yl)-(5-methyloxolan-2-yl)methyl]hydrazine
CID 105332713
1-(4,4-dimethylcyclohexyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515704
1-(2,3-dihydro-1-benzofuran-2-yl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104516055
1-(3-methoxypyrazin-2-yl)-N-methyl-1-(4-propylcyclohexyl)methanamine
CID 104515711
1-(3-methoxypyrazin-2-yl)-N-methyl-1-[3-(trifluoromethyl)cyclohexyl]methanamine
CID 105178723
[(3-methoxypyrazin-2-yl)-(3-methylcyclopentyl)methyl]hydrazine
CID 105233232
N-[(3-methoxypyrazin-2-yl)-(3-methyloxolan-2-yl)methyl]propan-1-amine
CID 105031966
1-(3-chloro-4-methoxyphenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 81330123
N-[cyclohexyl-(3-methoxypyrazin-2-yl)methyl]propan-1-amine
CID 104515379
[(3-methoxypyrazin-2-yl)-(oxolan-3-yl)methyl]hydrazine
CID 105229413
1-(4-bromophenyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 81330124
1-(5-ethoxy-3-pyridinyl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine
CID 105026304

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine (CID 105031831) is 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine is CNC(c1nccnc1OC)C1CCC(C)O1.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
The InChIKey is NXTGRMUWHOPPPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3O2/c1-8-4-5-9(17-8)10(13-2)11-12(16-3)15-7-6-14-11/h6-10,13H,4-5H2,1-3H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine?
1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine has a molecular weight of 237.30 g/mol, XLogP of 1.31, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)-N-methyl-1-(5-methyloxolan-2-yl)methanamine is sourced from PubChem (CID 105031831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).