1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine

C15H17N5 — CID 53201996

IUPAC1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine
SMILESCCCc1ncn2ccnc(NCc3ccccn3)c12
InChIInChI=1S/C15H17N5/c1-2-5-13-14-15(17-8-9-20(14)11-19-13)18-10-12-6-3-4-7-16-12/h3-4,6-9,11H,2,5,10H2,1H3,(H,17,18)
InChIKeyXPCGTRHKHLJYFU-UHFFFAOYSA-N
MW267.34 g/mol
LogP2.69
Rot. Bonds5

About 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine

1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine (PubChem CID 53201996) has the molecular formula C15H17N5 and a molecular weight of 267.34 g/mol. Its IUPAC name is 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine.

Molecular Properties

Compound Name1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine
PubChem CID53201996
Molecular FormulaC15H17N5
Molecular Weight267.34 g/mol
Exact Mass267.15
IUPAC Name1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine
SMILESCCCc1ncn2ccnc(NCc3ccccn3)c12
InChIInChI=1S/C15H17N5/c1-2-5-13-14-15(17-8-9-20(14)11-19-13)18-10-12-6-3-4-7-16-12/h3-4,6-9,11H,2,5,10H2,1H3,(H,17,18)
InChIKeyXPCGTRHKHLJYFU-UHFFFAOYSA-N
XLogP2.69
TPSA55.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.34
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine?
The IUPAC name of 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine (CID 53201996) is 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine.
What is the SMILES notation for 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine?
The canonical SMILES for 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine is CCCc1ncn2ccnc(NCc3ccccn3)c12.
What is the InChIKey of 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine?
The InChIKey is XPCGTRHKHLJYFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N5/c1-2-5-13-14-15(17-8-9-20(14)11-19-13)18-10-12-6-3-4-7-16-12/h3-4,6-9,11H,2,5,10H2,1H3,(H,17,18).
What are the key properties of 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine?
1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine has a molecular weight of 267.34 g/mol, XLogP of 2.69, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propyl-N-(pyridin-2-ylmethyl)imidazo[1,5-a]pyrazin-8-amine is sourced from PubChem (CID 53201996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).