N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine

C13H15N3 — CID 63967738

IUPACN-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine
SMILESCNC(C)c1ccccc1-c1cnccn1
InChIInChI=1S/C13H15N3/c1-10(14-2)11-5-3-4-6-12(11)13-9-15-7-8-16-13/h3-10,14H,1-2H3
InChIKeyAMXULZZBTNAZCI-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.42
Rot. Bonds3

About N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine

N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine (PubChem CID 63967738) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine.

Molecular Properties

Compound NameN-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine
PubChem CID63967738
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine
SMILESCNC(C)c1ccccc1-c1cnccn1
InChIInChI=1S/C13H15N3/c1-10(14-2)11-5-3-4-6-12(11)13-9-15-7-8-16-13/h3-10,14H,1-2H3
InChIKeyAMXULZZBTNAZCI-UHFFFAOYSA-N
XLogP2.42
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine?
The IUPAC name of N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine (CID 63967738) is N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine.
What is the SMILES notation for N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine?
The canonical SMILES for N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine is CNC(C)c1ccccc1-c1cnccn1.
What is the InChIKey of N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine?
The InChIKey is AMXULZZBTNAZCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10(14-2)11-5-3-4-6-12(11)13-9-15-7-8-16-13/h3-10,14H,1-2H3.
What are the key properties of N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine?
N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine has a molecular weight of 213.28 g/mol, XLogP of 2.42, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-pyrazin-2-ylphenyl)ethanamine is sourced from PubChem (CID 63967738), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).