N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine

C13H15N3 — CID 105083750

IUPACN-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1cnc(C)cn1
InChIInChI=1S/C13H15N3/c1-10-8-16-12(9-15-10)13(14-2)11-6-4-3-5-7-11/h3-9,13-14H,1-2H3
InChIKeyYJYWWCOXUHVZCE-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.09
Rot. Bonds3

About N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine

N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine (PubChem CID 105083750) has the molecular formula C13H15N3 and a molecular weight of 213.28 g/mol. Its IUPAC name is N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine.

Molecular Properties

Compound NameN-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine
PubChem CID105083750
Molecular FormulaC13H15N3
Molecular Weight213.28 g/mol
Exact Mass213.13
IUPAC NameN-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine
SMILESCNC(c1ccccc1)c1cnc(C)cn1
InChIInChI=1S/C13H15N3/c1-10-8-16-12(9-15-10)13(14-2)11-6-4-3-5-7-11/h3-9,13-14H,1-2H3
InChIKeyYJYWWCOXUHVZCE-UHFFFAOYSA-N
XLogP2.09
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 ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine?
The IUPAC name of N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine (CID 105083750) is N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine.
What is the SMILES notation for N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine?
The canonical SMILES for N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine is CNC(c1ccccc1)c1cnc(C)cn1.
What is the InChIKey of N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine?
The InChIKey is YJYWWCOXUHVZCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3/c1-10-8-16-12(9-15-10)13(14-2)11-6-4-3-5-7-11/h3-9,13-14H,1-2H3.
What are the key properties of N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine?
N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine has a molecular weight of 213.28 g/mol, XLogP of 2.09, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5-methylpyrazin-2-yl)-1-phenylmethanamine is sourced from PubChem (CID 105083750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).