N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine

C14H18N4O2 — CID 105065997

IUPACN-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine
SMILESCCNC(c1ccncc1)c1ncc(OC)nc1OC
InChIInChI=1S/C14H18N4O2/c1-4-16-12(10-5-7-15-8-6-10)13-14(20-3)18-11(19-2)9-17-13/h5-9,12,16H,4H2,1-3H3
InChIKeyUPYPIAJJAPHAQD-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.59
Rot. Bonds6

About N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine

N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine (PubChem CID 105065997) has the molecular formula C14H18N4O2 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine.

Molecular Properties

Compound NameN-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine
PubChem CID105065997
Molecular FormulaC14H18N4O2
Molecular Weight274.32 g/mol
Exact Mass274.14
IUPAC NameN-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine
SMILESCCNC(c1ccncc1)c1ncc(OC)nc1OC
InChIInChI=1S/C14H18N4O2/c1-4-16-12(10-5-7-15-8-6-10)13-14(20-3)18-11(19-2)9-17-13/h5-9,12,16H,4H2,1-3H3
InChIKeyUPYPIAJJAPHAQD-UHFFFAOYSA-N
XLogP1.59
TPSA69.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[(4-ethylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515338
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-3-methylbutan-1-amine
CID 105030945
1-(3,5-dimethoxypyrazin-2-yl)-2-pyridin-4-ylethanamine
CID 105178270
1-(3,5-dimethoxypyrazin-2-yl)-N-methyl-1-(2-methyl-4-pyridinyl)methanamine
CID 106755786
2-cyclopropyl-1-(3,5-dimethoxypyrazin-2-yl)-N-ethylpropan-1-amine
CID 105031029
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-3-methoxy-3-methylbutan-1-amine
CID 103029167
N-[(3,5-dimethoxypyrazin-2-yl)-(2-methylpyrazol-3-yl)methyl]propan-1-amine
CID 105178358
1-(3,5-dimethoxypyrazin-2-yl)-N-ethyl-2-propoxyethanamine
CID 107946650
N-[(3-chlorothiophen-2-yl)-(3,5-dimethoxypyrazin-2-yl)methyl]propan-1-amine
CID 105031226
N-[(2,6-dimethoxyphenyl)-pyridin-4-ylmethyl]ethanamine
CID 116810303
[(3,5-dimethoxypyrazin-2-yl)-(3-methoxyphenyl)methyl]hydrazine
CID 105332206
N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine
CID 104515368

Frequently Asked Questions

What is the IUPAC name of N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine?
The IUPAC name of N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine (CID 105065997) is N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine.
What is the SMILES notation for N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine?
The canonical SMILES for N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine is CCNC(c1ccncc1)c1ncc(OC)nc1OC.
What is the InChIKey of N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine?
The InChIKey is UPYPIAJJAPHAQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O2/c1-4-16-12(10-5-7-15-8-6-10)13-14(20-3)18-11(19-2)9-17-13/h5-9,12,16H,4H2,1-3H3.
What are the key properties of N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine?
N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine has a molecular weight of 274.32 g/mol, XLogP of 1.59, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3,5-dimethoxypyrazin-2-yl)-pyridin-4-ylmethyl]ethanamine is sourced from PubChem (CID 105065997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).