N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine

C12H16N4O — CID 141342031

IUPACN-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2ccnc2c(NCC2CCCCO2)n1
InChIInChI=1S/C12H16N4O/c1-2-8-17-10(3-1)9-15-11-12-14-5-7-16(12)6-4-13-11/h4-7,10H,1-3,8-9H2,(H,13,15)
InChIKeyCIPXIAXZMFZFOJ-UHFFFAOYSA-N
MW232.29 g/mol
LogP1.71
Rot. Bonds3

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

N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (PubChem CID 141342031) has the molecular formula C12H16N4O and a molecular weight of 232.29 g/mol. Its IUPAC name is N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
PubChem CID141342031
Molecular FormulaC12H16N4O
Molecular Weight232.29 g/mol
Exact Mass232.13
IUPAC NameN-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine
SMILESc1cn2ccnc2c(NCC2CCCCO2)n1
InChIInChI=1S/C12H16N4O/c1-2-8-17-10(3-1)9-15-11-12-14-5-7-16(12)6-4-13-11/h4-7,10H,1-3,8-9H2,(H,13,15)
InChIKeyCIPXIAXZMFZFOJ-UHFFFAOYSA-N
XLogP1.71
TPSA51.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine (CID 141342031) is N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is c1cn2ccnc2c(NCC2CCCCO2)n1.
What is the InChIKey of N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is CIPXIAXZMFZFOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N4O/c1-2-8-17-10(3-1)9-15-11-12-14-5-7-16(12)6-4-13-11/h4-7,10H,1-3,8-9H2,(H,13,15).
What are the key properties of N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine?
N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 232.29 g/mol, XLogP of 1.71, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxan-2-ylmethyl)imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 141342031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).