1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine

C15H19N3O — CID 104514796

IUPAC1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
SMILESCCc1ccc(C(C)(N)c2nccnc2OC)cc1
InChIInChI=1S/C15H19N3O/c1-4-11-5-7-12(8-6-11)15(2,16)13-14(19-3)18-10-9-17-13/h5-10H,4,16H2,1-3H3
InChIKeyWENUPOMDRVWFSP-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.27
Rot. Bonds4

About 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine

1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine (PubChem CID 104514796) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine.

Molecular Properties

Compound Name1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
PubChem CID104514796
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine
SMILESCCc1ccc(C(C)(N)c2nccnc2OC)cc1
InChIInChI=1S/C15H19N3O/c1-4-11-5-7-12(8-6-11)15(2,16)13-14(19-3)18-10-9-17-13/h5-10H,4,16H2,1-3H3
InChIKeyWENUPOMDRVWFSP-UHFFFAOYSA-N
XLogP2.27
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(4-fluorophenyl)-2-(3-methoxypyrazin-2-yl)propan-2-amine
CID 114833857
2-(3-methoxypyrazin-2-yl)-2-methylpropan-1-amine
CID 104516755
1-(4-ethylphenyl)-1-(4-propylphenyl)ethanamine
CID 63408118
1-(4-ethylphenyl)-1-quinolin-8-ylethanamine
CID 81197487
1-tert-butyl-4-ethylbenzene
CID 157359507
1-(3-methoxypyrazin-2-yl)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethanol
CID 104514467
2-(3-methoxypyrazin-2-yl)-N-methylpropan-2-amine
CID 175976338
2-(4-ethylphenyl)-1-(2-methoxy-3-pyridinyl)ethanamine
CID 105101378
2-amino-2-(4-ethylphenyl)propan-1-ol
CID 61054820
1-(4-ethylphenyl)-1-(5-methyl-3-pyridinyl)ethanamine
CID 113297034
N-[(4-ethylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515338
3-(3-methoxypyrazin-2-yl)-3-methyl-N-propylbutan-1-amine
CID 104516794

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine?
The IUPAC name of 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine (CID 104514796) is 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine.
What is the SMILES notation for 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine?
The canonical SMILES for 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine is CCc1ccc(C(C)(N)c2nccnc2OC)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine?
The InChIKey is WENUPOMDRVWFSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-11-5-7-12(8-6-11)15(2,16)13-14(19-3)18-10-9-17-13/h5-10H,4,16H2,1-3H3.
What are the key properties of 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine?
1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine has a molecular weight of 257.34 g/mol, XLogP of 2.27, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-1-(3-methoxypyrazin-2-yl)ethanamine is sourced from PubChem (CID 104514796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).