N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine

C13H24N4O — CID 113325024

IUPACN-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(CCOc1cncc(CN)n1)C(C)C
InChIInChI=1S/C13H24N4O/c1-10(2)17(11(3)4)5-6-18-13-9-15-8-12(7-14)16-13/h8-11H,5-7,14H2,1-4H3
InChIKeyOYRVJKOALSJIRU-UHFFFAOYSA-N
MW252.36 g/mol
LogP1.43
Rot. Bonds7

About N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine

N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine (PubChem CID 113325024) has the molecular formula C13H24N4O and a molecular weight of 252.36 g/mol. Its IUPAC name is N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine
PubChem CID113325024
Molecular FormulaC13H24N4O
Molecular Weight252.36 g/mol
Exact Mass252.20
IUPAC NameN-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine
SMILESCC(C)N(CCOc1cncc(CN)n1)C(C)C
InChIInChI=1S/C13H24N4O/c1-10(2)17(11(3)4)5-6-18-13-9-15-8-12(7-14)16-13/h8-11H,5-7,14H2,1-4H3
InChIKeyOYRVJKOALSJIRU-UHFFFAOYSA-N
XLogP1.43
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine (CID 113325024) is N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine is CC(C)N(CCOc1cncc(CN)n1)C(C)C.
What is the InChIKey of N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is OYRVJKOALSJIRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N4O/c1-10(2)17(11(3)4)5-6-18-13-9-15-8-12(7-14)16-13/h8-11H,5-7,14H2,1-4H3.
What are the key properties of N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine?
N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 252.36 g/mol, XLogP of 1.43, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[6-(aminomethyl)pyrazin-2-yl]oxyethyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 113325024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).