N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine

C15H18FN3O — CID 66451987

IUPACN-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cncc(Oc2ccccc2F)n1
InChIInChI=1S/C15H18FN3O/c1-15(2,3)18-9-11-8-17-10-14(19-11)20-13-7-5-4-6-12(13)16/h4-8,10,18H,9H2,1-3H3
InChIKeyPFFPOWYIMIQVBA-UHFFFAOYSA-N
MW275.33 g/mol
LogP3.30
Rot. Bonds4

About N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine

N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine (PubChem CID 66451987) has the molecular formula C15H18FN3O and a molecular weight of 275.33 g/mol. Its IUPAC name is N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
PubChem CID66451987
Molecular FormulaC15H18FN3O
Molecular Weight275.33 g/mol
Exact Mass275.14
IUPAC NameN-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cncc(Oc2ccccc2F)n1
InChIInChI=1S/C15H18FN3O/c1-15(2,3)18-9-11-8-17-10-14(19-11)20-13-7-5-4-6-12(13)16/h4-8,10,18H,9H2,1-3H3
InChIKeyPFFPOWYIMIQVBA-UHFFFAOYSA-N
XLogP3.30
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.33
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-N-[(6-phenylmethoxypyrazin-2-yl)methyl]propan-2-amine
CID 66451944
N-[[6-(2-chloro-4-methylphenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine
CID 66468621
N-[[6-(2,3-difluorophenoxy)pyrazin-2-yl]methyl]ethanamine
CID 66466578
2-methyl-N-[[6-(2-methylsulfanylphenoxy)-2-pyridinyl]methyl]propan-2-amine
CID 63647366
N-methyl-1-(6-naphthalen-1-yloxypyrazin-2-yl)methanamine
CID 66450632
1-[6-(2-bromophenoxy)pyrazin-2-yl]-N-methylmethanamine
CID 66450805
N-[[6-(2,4-difluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-1-amine
CID 66451593
1-[6-[(tert-butylamino)methyl]pyrazin-2-yl]oxy-N,N,2-trimethylpropan-2-amine
CID 79678942
2-(chloromethyl)-6-(2,3-difluorophenoxy)pyrazine
CID 66466210
2-methyl-N-[[6-(2-thiophen-2-ylethoxy)pyrazin-2-yl]methyl]propan-2-amine
CID 66465894
N-[(6-but-3-enoxypyrazin-2-yl)methyl]-2-methylpropan-2-amine
CID 66451941
N-[[6-(2,5-difluorophenoxy)pyrazin-2-yl]methyl]cyclopropanamine
CID 66467503

Frequently Asked Questions

What is the IUPAC name of N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine (CID 66451987) is N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cncc(Oc2ccccc2F)n1.
What is the InChIKey of N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
The InChIKey is PFFPOWYIMIQVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O/c1-15(2,3)18-9-11-8-17-10-14(19-11)20-13-7-5-4-6-12(13)16/h4-8,10,18H,9H2,1-3H3.
What are the key properties of N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine?
N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine has a molecular weight of 275.33 g/mol, XLogP of 3.30, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-(2-fluorophenoxy)pyrazin-2-yl]methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 66451987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).