N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine

C15H19N3O — CID 104515368

IUPACN-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(C)c1)c1nccnc1OC
InChIInChI=1S/C15H19N3O/c1-4-16-13(12-7-5-6-11(2)10-12)14-15(19-3)18-9-8-17-14/h5-10,13,16H,4H2,1-3H3
InChIKeySWYXCWHAPCSXAQ-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.49
Rot. Bonds5

About N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine

N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine (PubChem CID 104515368) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine
PubChem CID104515368
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine
SMILESCCNC(c1cccc(C)c1)c1nccnc1OC
InChIInChI=1S/C15H19N3O/c1-4-16-13(12-7-5-6-11(2)10-12)14-15(19-3)18-9-8-17-14/h5-10,13,16H,4H2,1-3H3
InChIKeySWYXCWHAPCSXAQ-UHFFFAOYSA-N
XLogP2.49
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3-methoxy-4-methylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 105031993
N-[(4-methoxy-3-methylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104516007
N-[(4-ethylphenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515338
N-[isoquinolin-1-yl-(3-methylphenyl)methyl]ethanamine
CID 63948857
N-[(2,6-difluorophenyl)-(3-methoxypyrazin-2-yl)methyl]ethanamine
CID 104515889
N-[(3-methoxyphenyl)-(3-methylphenyl)methyl]ethanamine
CID 60797781
N-[(3,4-dimethylphenyl)-(3-methoxypyrazin-2-yl)methyl]propan-1-amine
CID 105032115
N-[(2-methoxy-3-pyridinyl)-(3-methylphenyl)methyl]propan-1-amine
CID 105090915
N-[(3,4-dimethoxyphenyl)-(3-methylphenyl)methyl]ethanamine
CID 43488776
N-[(6-methoxypyridazin-3-yl)-(3-methylphenyl)methyl]ethanamine
CID 103374514
1-(3-methoxyphenyl)-1-(3-methoxypyrazin-2-yl)-N-methylmethanamine
CID 104515256
N-[(3-chloro-5-methylphenyl)-(3-methoxypyrazin-2-yl)methyl]propan-1-amine
CID 105031892

Frequently Asked Questions

What is the IUPAC name of N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine?
The IUPAC name of N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine (CID 104515368) is N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine.
What is the SMILES notation for N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine?
The canonical SMILES for N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine is CCNC(c1cccc(C)c1)c1nccnc1OC.
What is the InChIKey of N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine?
The InChIKey is SWYXCWHAPCSXAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-4-16-13(12-7-5-6-11(2)10-12)14-15(19-3)18-9-8-17-14/h5-10,13,16H,4H2,1-3H3.
What are the key properties of N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine?
N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine has a molecular weight of 257.34 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methoxypyrazin-2-yl)-(3-methylphenyl)methyl]ethanamine is sourced from PubChem (CID 104515368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).