7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine

C14H25N5 — CID 64575062

IUPAC7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCCCC1(CN2CCn3cnnc3C2)CCCNC1
InChIInChI=1S/C14H25N5/c1-2-4-14(5-3-6-15-10-14)11-18-7-8-19-12-16-17-13(19)9-18/h12,15H,2-11H2,1H3
InChIKeyDRKWLLMBTOZJHI-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.26
Rot. Bonds4

About 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine

7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine (PubChem CID 64575062) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine.

Molecular Properties

Compound Name7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
PubChem CID64575062
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC Name7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
SMILESCCCC1(CN2CCn3cnnc3C2)CCCNC1
InChIInChI=1S/C14H25N5/c1-2-4-14(5-3-6-15-10-14)11-18-7-8-19-12-16-17-13(19)9-18/h12,15H,2-11H2,1H3
InChIKeyDRKWLLMBTOZJHI-UHFFFAOYSA-N
XLogP1.26
TPSA45.98 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?
The IUPAC name of 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine (CID 64575062) is 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine.
What is the SMILES notation for 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?
The canonical SMILES for 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine is CCCC1(CN2CCn3cnnc3C2)CCCNC1.
What is the InChIKey of 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?
The InChIKey is DRKWLLMBTOZJHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-2-4-14(5-3-6-15-10-14)11-18-7-8-19-12-16-17-13(19)9-18/h12,15H,2-11H2,1H3.
What are the key properties of 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine?
7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine has a molecular weight of 263.39 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(3-propylpiperidin-3-yl)methyl]-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine is sourced from PubChem (CID 64575062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).