6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine

C13H15FN4 — CID 66451652

IUPAC6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1cncc(CN)n1
InChIInChI=1S/C13H15FN4/c1-18(9-10-2-4-11(14)5-3-10)13-8-16-7-12(6-15)17-13/h2-5,7-8H,6,9,15H2,1H3
InChIKeySRILQFRLYPIHSN-UHFFFAOYSA-N
MW246.29 g/mol
LogP1.71
Rot. Bonds4

About 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine

6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine (PubChem CID 66451652) has the molecular formula C13H15FN4 and a molecular weight of 246.29 g/mol. Its IUPAC name is 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
PubChem CID66451652
Molecular FormulaC13H15FN4
Molecular Weight246.29 g/mol
Exact Mass246.13
IUPAC Name6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1cncc(CN)n1
InChIInChI=1S/C13H15FN4/c1-18(9-10-2-4-11(14)5-3-10)13-8-16-7-12(6-15)17-13/h2-5,7-8H,6,9,15H2,1H3
InChIKeySRILQFRLYPIHSN-UHFFFAOYSA-N
XLogP1.71
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
CID 54943226
6-(aminomethyl)-N-[(2-fluorophenyl)methyl]-N-methylpyrazin-2-amine
CID 66456456
2-N-[(4-fluorophenyl)methyl]-2-N-methyl-6-N-propylpyrazine-2,6-diamine
CID 80794812
[6-[methyl(pyridin-4-ylmethyl)amino]pyrazin-2-yl]methanol
CID 66467748
6-(chloromethyl)-N-methyl-N-(pyridin-4-ylmethyl)pyrazin-2-amine
CID 66468007
[6-[benzyl(methyl)amino]pyrazin-2-yl]methanol
CID 66466595
6-(chloromethyl)-N-[(4-methoxyphenyl)methyl]-N-methylpyrazin-2-amine
CID 66466186
6-(aminomethyl)-5-chloro-N-[(4-fluorophenyl)methyl]-N-methylpyridin-2-amine
CID 62286054
5-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrimidin-2-amine
CID 113388103
[6-[(4-fluorophenyl)methyl-methylamino]-2-pyridinyl]methanol
CID 62253214
3-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyridin-4-amine
CID 81246480
[6-[[(4-fluorophenyl)methyl-methylamino]methyl]-2-pyridinyl]methanamine
CID 106905327

Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The IUPAC name of 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine (CID 66451652) is 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine.
What is the SMILES notation for 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The canonical SMILES for 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine is CN(Cc1ccc(F)cc1)c1cncc(CN)n1.
What is the InChIKey of 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The InChIKey is SRILQFRLYPIHSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15FN4/c1-18(9-10-2-4-11(14)5-3-10)13-8-16-7-12(6-15)17-13/h2-5,7-8H,6,9,15H2,1H3.
What are the key properties of 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine has a molecular weight of 246.29 g/mol, XLogP of 1.71, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 66451652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).