N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine

C14H16N6 — CID 103127215

IUPACN-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1cnn2ccncc12
InChIInChI=1S/C14H16N6/c1-2-3-18-14(12-9-15-4-5-17-12)11-8-19-20-7-6-16-10-13(11)20/h4-10,14,18H,2-3H2,1H3
InChIKeyJNAMNXVBWIOLTK-UHFFFAOYSA-N
MW268.32 g/mol
LogP1.61
Rot. Bonds5

About N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine

N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine (PubChem CID 103127215) has the molecular formula C14H16N6 and a molecular weight of 268.32 g/mol. Its IUPAC name is N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine.

Molecular Properties

Compound NameN-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine
PubChem CID103127215
Molecular FormulaC14H16N6
Molecular Weight268.32 g/mol
Exact Mass268.14
IUPAC NameN-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine
SMILESCCCNC(c1cnccn1)c1cnn2ccncc12
InChIInChI=1S/C14H16N6/c1-2-3-18-14(12-9-15-4-5-17-12)11-8-19-20-7-6-16-10-13(11)20/h4-10,14,18H,2-3H2,1H3
InChIKeyJNAMNXVBWIOLTK-UHFFFAOYSA-N
XLogP1.61
TPSA68.00 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.32
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine?
The IUPAC name of N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine (CID 103127215) is N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine.
What is the SMILES notation for N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine?
The canonical SMILES for N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine is CCCNC(c1cnccn1)c1cnn2ccncc12.
What is the InChIKey of N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine?
The InChIKey is JNAMNXVBWIOLTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6/c1-2-3-18-14(12-9-15-4-5-17-12)11-8-19-20-7-6-16-10-13(11)20/h4-10,14,18H,2-3H2,1H3.
What are the key properties of N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine?
N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine has a molecular weight of 268.32 g/mol, XLogP of 1.61, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[pyrazin-2-yl(pyrazolo[1,5-a]pyrazin-3-yl)methyl]propan-1-amine is sourced from PubChem (CID 103127215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).