5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine

C15H23N5 — CID 103057590

IUPAC5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine
SMILESCCCNc1cnc(Cn2nc(CC)cc2CC)cn1
InChIInChI=1S/C15H23N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-14(6-3)8-12(5-2)19-20/h8-10H,4-7,11H2,1-3H3,(H,16,18)
InChIKeyUYSFIOLLILZLCD-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.67
Rot. Bonds7

About 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine

5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine (PubChem CID 103057590) has the molecular formula C15H23N5 and a molecular weight of 273.38 g/mol. Its IUPAC name is 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine.

Molecular Properties

Compound Name5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine
PubChem CID103057590
Molecular FormulaC15H23N5
Molecular Weight273.38 g/mol
Exact Mass273.20
IUPAC Name5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine
SMILESCCCNc1cnc(Cn2nc(CC)cc2CC)cn1
InChIInChI=1S/C15H23N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-14(6-3)8-12(5-2)19-20/h8-10H,4-7,11H2,1-3H3,(H,16,18)
InChIKeyUYSFIOLLILZLCD-UHFFFAOYSA-N
XLogP2.67
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine?
The IUPAC name of 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine (CID 103057590) is 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine.
What is the SMILES notation for 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine?
The canonical SMILES for 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine is CCCNc1cnc(Cn2nc(CC)cc2CC)cn1.
What is the InChIKey of 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine?
The InChIKey is UYSFIOLLILZLCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5/c1-4-7-16-15-10-17-13(9-18-15)11-20-14(6-3)8-12(5-2)19-20/h8-10H,4-7,11H2,1-3H3,(H,16,18).
What are the key properties of 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine?
5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine has a molecular weight of 273.38 g/mol, XLogP of 2.67, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,5-diethylpyrazol-1-yl)methyl]-N-propylpyrazin-2-amine is sourced from PubChem (CID 103057590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).