5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine

C16H19FN4 — CID 107379846

IUPAC5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1cnc(CNC2CC2)cn1
InChIInChI=1S/C16H19FN4/c1-21(11-12-2-4-13(17)5-3-12)16-10-19-15(9-20-16)8-18-14-6-7-14/h2-5,9-10,14,18H,6-8,11H2,1H3
InChIKeyHWOOSUCYQNREPL-UHFFFAOYSA-N
MW286.35 g/mol
LogP2.50
Rot. Bonds6

About 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine

5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine (PubChem CID 107379846) has the molecular formula C16H19FN4 and a molecular weight of 286.35 g/mol. Its IUPAC name is 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine.

Molecular Properties

Compound Name5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
PubChem CID107379846
Molecular FormulaC16H19FN4
Molecular Weight286.35 g/mol
Exact Mass286.16
IUPAC Name5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine
SMILESCN(Cc1ccc(F)cc1)c1cnc(CNC2CC2)cn1
InChIInChI=1S/C16H19FN4/c1-21(11-12-2-4-13(17)5-3-12)16-10-19-15(9-20-16)8-18-14-6-7-14/h2-5,9-10,14,18H,6-8,11H2,1H3
InChIKeyHWOOSUCYQNREPL-UHFFFAOYSA-N
XLogP2.50
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-[(cyclopropylamino)methyl]-N-methyl-N-(thiophen-3-ylmethyl)pyrazin-2-amine
CID 107379171
5-[(cyclopropylamino)methyl]-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]pyrazin-2-amine
CID 107380594
5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methyl-1,3-thiazol-2-amine
CID 62753295
5-[(cyclopropylamino)methyl]-N-(2-fluorophenyl)-N-methylpyrazin-2-amine
CID 107379625
N-[(4-bromophenyl)methyl]-5-[(cyclopropylamino)methyl]-N-methylpyridin-2-amine
CID 62287672
N-[(4-bromophenyl)methyl]-N-methyl-5-(methylaminomethyl)pyrazin-2-amine
CID 107379910
5-[(cyclopropylamino)methyl]-N-methyl-N-(oxolan-2-ylmethyl)pyrazin-2-amine
CID 107379575
6-[(cyclopropylamino)methyl]-N-methyl-N-(pyridin-4-ylmethyl)pyridin-2-amine
CID 62284157
5-[(cyclopropylamino)methyl]-N-(2,4-dimethylphenyl)-N-methylpyrazin-2-amine
CID 107379665
5-[(cyclopropylamino)methyl]-N-ethyl-N-(pyridin-2-ylmethyl)pyrazin-2-amine
CID 107380589
6-[(cyclopropylamino)methyl]-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]pyrazin-2-amine
CID 66451248
6-[(cyclopropylamino)methyl]-N-[(2-fluorophenyl)methyl]-N-methylpyridin-2-amine
CID 62295485

Frequently Asked Questions

What is the IUPAC name of 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The IUPAC name of 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine (CID 107379846) is 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine.
What is the SMILES notation for 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The canonical SMILES for 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine is CN(Cc1ccc(F)cc1)c1cnc(CNC2CC2)cn1.
What is the InChIKey of 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
The InChIKey is HWOOSUCYQNREPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4/c1-21(11-12-2-4-13(17)5-3-12)16-10-19-15(9-20-16)8-18-14-6-7-14/h2-5,9-10,14,18H,6-8,11H2,1H3.
What are the key properties of 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine?
5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine has a molecular weight of 286.35 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(cyclopropylamino)methyl]-N-[(4-fluorophenyl)methyl]-N-methylpyrazin-2-amine is sourced from PubChem (CID 107379846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).