4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine

C14H25N3O2 — CID 105178681

IUPAC4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
SMILESCCCNC(CC(C)COC)c1nccnc1OC
InChIInChI=1S/C14H25N3O2/c1-5-6-15-12(9-11(2)10-18-3)13-14(19-4)17-8-7-16-13/h7-8,11-12,15H,5-6,9-10H2,1-4H3
InChIKeyWVSWDGRSJZYYKW-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.20
Rot. Bonds9

About 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine

4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine (PubChem CID 105178681) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine.

Molecular Properties

Compound Name4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
PubChem CID105178681
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
SMILESCCCNC(CC(C)COC)c1nccnc1OC
InChIInChI=1S/C14H25N3O2/c1-5-6-15-12(9-11(2)10-18-3)13-14(19-4)17-8-7-16-13/h7-8,11-12,15H,5-6,9-10H2,1-4H3
InChIKeyWVSWDGRSJZYYKW-UHFFFAOYSA-N
XLogP2.20
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(3,5-dimethoxypyrazin-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105178242
1-(3-methoxypyrazin-2-yl)-N-propylpentan-1-amine
CID 113421622
1-(1-ethylimidazol-2-yl)-4-methoxy-3-methyl-N-propylbutan-1-amine
CID 105149787
N-[2-tert-butylsulfanyl-1-(3-methoxypyrazin-2-yl)ethyl]propan-1-amine
CID 104515657
1-(3-methoxypyrazin-2-yl)-N,3-dimethylpentan-1-amine
CID 105031969
1-(3,5-dimethoxypyrazin-2-yl)-3-methyl-N-propylpentan-1-amine
CID 105031186
[2-methoxy-1-(3-methoxypyrazin-2-yl)ethyl]hydrazine
CID 105207269
N-[1-(3-methoxypyrazin-2-yl)-2-(2-methylphenyl)ethyl]propan-1-amine
CID 104515448
N-[1-(3-methoxypyrazin-2-yl)-2-thiophen-3-ylethyl]propan-1-amine
CID 105178677
N-[2,2,2-trifluoro-1-(3-methoxypyrazin-2-yl)ethyl]propan-1-amine
CID 105032098
N-[2-(cyclohexen-1-yl)-1-(3-methoxypyrazin-2-yl)ethyl]propan-1-amine
CID 116662144
2-ethoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 116721761

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine?
The IUPAC name of 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine (CID 105178681) is 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine.
What is the SMILES notation for 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine?
The canonical SMILES for 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine is CCCNC(CC(C)COC)c1nccnc1OC.
What is the InChIKey of 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine?
The InChIKey is WVSWDGRSJZYYKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-5-6-15-12(9-11(2)10-18-3)13-14(19-4)17-8-7-16-13/h7-8,11-12,15H,5-6,9-10H2,1-4H3.
What are the key properties of 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine?
4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.20, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine is sourced from PubChem (CID 105178681), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).