1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine

C11H19N3O — CID 104515585

IUPAC1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine
SMILESCCC(C)C(NC)c1nccnc1OC
InChIInChI=1S/C11H19N3O/c1-5-8(2)9(12-3)10-11(15-4)14-7-6-13-10/h6-9,12H,5H2,1-4H3
InChIKeyDDMXENFGOSZQMT-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.79
Rot. Bonds5

About 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine

1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine (PubChem CID 104515585) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine.

Molecular Properties

Compound Name1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine
PubChem CID104515585
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine
SMILESCCC(C)C(NC)c1nccnc1OC
InChIInChI=1S/C11H19N3O/c1-5-8(2)9(12-3)10-11(15-4)14-7-6-13-10/h6-9,12H,5H2,1-4H3
InChIKeyDDMXENFGOSZQMT-UHFFFAOYSA-N
XLogP1.79
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-methoxypyrazin-2-yl)-N-methylpropan-1-amine
CID 104515370
1-(3-methoxypyrazin-2-yl)-N,3-dimethylpentan-1-amine
CID 105031969
N-ethyl-1-(3-methoxypyrazin-2-yl)-2,3-dimethylbutan-1-amine
CID 105032262
2,2,2-trifluoro-1-(3-methoxypyrazin-2-yl)-N-methylethanamine
CID 105032213
1-(3-methoxypyrazin-2-yl)-N-methylpentan-1-amine
CID 104515877
1-(3-methoxypyrazin-2-yl)-N-methyldecan-1-amine
CID 105032040
2-ethoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 116721761
N,2-dimethyl-1-(1,3-thiazol-2-yl)butan-1-amine
CID 61330921
1-(3-methoxypyrazin-2-yl)-N-methyl-1-(4-propylthiadiazol-5-yl)methanamine
CID 105178581
1-isoquinolin-1-yl-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515594
1-(4-ethoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 105032032
1-(3-methoxypyrazin-2-yl)-2-(propylamino)ethanol
CID 104516706

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine?
The IUPAC name of 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine (CID 104515585) is 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine.
What is the SMILES notation for 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine?
The canonical SMILES for 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine is CCC(C)C(NC)c1nccnc1OC.
What is the InChIKey of 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine?
The InChIKey is DDMXENFGOSZQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-5-8(2)9(12-3)10-11(15-4)14-7-6-13-10/h6-9,12H,5H2,1-4H3.
What are the key properties of 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine?
1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine has a molecular weight of 209.29 g/mol, XLogP of 1.79, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypyrazin-2-yl)-N,2-dimethylbutan-1-amine is sourced from PubChem (CID 104515585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).