2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine

C14H25N3O2 — CID 116727206

IUPAC2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine
SMILESCCCNC(c1nccnc1OC)C(C)(C)OCC
InChIInChI=1S/C14H25N3O2/c1-6-8-16-12(14(3,4)19-7-2)11-13(18-5)17-10-9-15-11/h9-10,12,16H,6-8H2,1-5H3
InChIKeyBEBWIGQULGUKBK-UHFFFAOYSA-N
MW267.37 g/mol
LogP2.34
Rot. Bonds8

About 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine

2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine (PubChem CID 116727206) has the molecular formula C14H25N3O2 and a molecular weight of 267.37 g/mol. Its IUPAC name is 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine.

Molecular Properties

Compound Name2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine
PubChem CID116727206
Molecular FormulaC14H25N3O2
Molecular Weight267.37 g/mol
Exact Mass267.19
IUPAC Name2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine
SMILESCCCNC(c1nccnc1OC)C(C)(C)OCC
InChIInChI=1S/C14H25N3O2/c1-6-8-16-12(14(3,4)19-7-2)11-13(18-5)17-10-9-15-11/h9-10,12,16H,6-8H2,1-5H3
InChIKeyBEBWIGQULGUKBK-UHFFFAOYSA-N
XLogP2.34
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.37
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2,2,2-trifluoro-1-(3-methoxypyrazin-2-yl)ethyl]propan-1-amine
CID 105032098
2-ethyl-1-(3-methoxypyrazin-2-yl)-2-N,2-N-dimethyl-1-N-propylbutane-1,2-diamine
CID 104515831
2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 116726340
[2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methylbutyl]hydrazine
CID 105274810
2-ethoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 116721761
N-[2-tert-butylsulfanyl-1-(3-methoxypyrazin-2-yl)ethyl]propan-1-amine
CID 104515657
1-(3-methoxypyrazin-2-yl)-N-propylpentan-1-amine
CID 113421622
N-[cyclohexyl-(3-methoxypyrazin-2-yl)methyl]propan-1-amine
CID 104515379
N-ethyl-1-(3-methoxypyrazin-2-yl)-2-methyl-2-phenylpropan-1-amine
CID 104515547
4-methoxy-1-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 105178681
N-[(3-methoxypyrazin-2-yl)-pyrimidin-5-ylmethyl]propan-1-amine
CID 102923780
N-[(1-ethoxycyclopentyl)-(3-methoxypyrazin-2-yl)methyl]propan-1-amine
CID 116762484

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine?
The IUPAC name of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine (CID 116727206) is 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine.
What is the SMILES notation for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine?
The canonical SMILES for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine is CCCNC(c1nccnc1OC)C(C)(C)OCC.
What is the InChIKey of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine?
The InChIKey is BEBWIGQULGUKBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O2/c1-6-8-16-12(14(3,4)19-7-2)11-13(18-5)17-10-9-15-11/h9-10,12,16H,6-8H2,1-5H3.
What are the key properties of 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine?
2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine has a molecular weight of 267.37 g/mol, XLogP of 2.34, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1-(3-methoxypyrazin-2-yl)-2-methyl-N-propylpropan-1-amine is sourced from PubChem (CID 116727206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).