N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine

C15H19N3O — CID 131963860

IUPACN-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine
SMILESCOc1ccccc1CNC(C)Cc1cnccn1
InChIInChI=1S/C15H19N3O/c1-12(9-14-11-16-7-8-17-14)18-10-13-5-3-4-6-15(13)19-2/h3-8,11-12,18H,9-10H2,1-2H3
InChIKeyCCCAYPCURWIZDG-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.21
Rot. Bonds6

About N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine

N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine (PubChem CID 131963860) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine
PubChem CID131963860
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine
SMILESCOc1ccccc1CNC(C)Cc1cnccn1
InChIInChI=1S/C15H19N3O/c1-12(9-14-11-16-7-8-17-14)18-10-13-5-3-4-6-15(13)19-2/h3-8,11-12,18H,9-10H2,1-2H3
InChIKeyCCCAYPCURWIZDG-UHFFFAOYSA-N
XLogP2.21
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(2-methoxyphenyl)-N-(1-pyrazin-2-ylpropan-2-yl)propanamide
CID 91775688
1-phenyl-N-(pyrazin-2-ylmethyl)propan-2-amine
CID 63011423
(2R)-2-N-[(2-methoxyphenyl)methyl]propane-1,2-diamine
CID 104867958
N-[(2-methoxyphenyl)methyl]propan-2-amine
CID 11458027
1-(2-methoxyphenyl)-N-(pyridazin-3-ylmethyl)propan-2-amine
CID 106895370
1-(2-methoxyphenyl)-N-(1,3-thiazol-2-ylmethyl)propan-2-amine
CID 61285032
N-[[3-(2-chlorophenyl)-1-(4-fluorophenyl)pyrazol-4-yl]methyl]-1-pyrazin-2-ylpropan-2-amine
CID 45193650
3-N-[(2-methoxyphenyl)methyl]-1-N,1-N-dimethylbutane-1,3-diamine
CID 54963960
1-cyclopropyl-N-[(2-methoxyphenyl)methyl]propan-2-amine
CID 63990355
1-(2-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]ethanamine
CID 43177778
(2S)-N-[(2-methoxyphenyl)methyl]-1-(1,2,4-triazol-1-yl)propan-2-amine
CID 129369537
N-[[3-(3-fluorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl]-1-pyrazin-2-ylpropan-2-amine
CID 45174955

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine?
The IUPAC name of N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine (CID 131963860) is N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine.
What is the SMILES notation for N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine?
The canonical SMILES for N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine is COc1ccccc1CNC(C)Cc1cnccn1.
What is the InChIKey of N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine?
The InChIKey is CCCAYPCURWIZDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-12(9-14-11-16-7-8-17-14)18-10-13-5-3-4-6-15(13)19-2/h3-8,11-12,18H,9-10H2,1-2H3.
What are the key properties of N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine?
N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine has a molecular weight of 257.34 g/mol, XLogP of 2.21, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxyphenyl)methyl]-1-pyrazin-2-ylpropan-2-amine is sourced from PubChem (CID 131963860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).