N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine

C13H18N4O — CID 164639712

IUPACN-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCN(C[C@H]1CCCOC1)c1nccn2ccnc12
InChIInChI=1S/C13H18N4O/c1-16(9-11-3-2-8-18-10-11)12-13-15-5-7-17(13)6-4-14-12/h4-7,11H,2-3,8-10H2,1H3/t11-/m1/s1
InChIKeyAXVYMCARKHYDBG-LLVKDONJSA-N
MW246.31 g/mol
LogP1.59
Rot. Bonds3

About N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine

N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine (PubChem CID 164639712) has the molecular formula C13H18N4O and a molecular weight of 246.31 g/mol. Its IUPAC name is N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine.

Molecular Properties

Compound NameN-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine
PubChem CID164639712
Molecular FormulaC13H18N4O
Molecular Weight246.31 g/mol
Exact Mass246.15
IUPAC NameN-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine
SMILESCN(C[C@H]1CCCOC1)c1nccn2ccnc12
InChIInChI=1S/C13H18N4O/c1-16(9-11-3-2-8-18-10-11)12-13-15-5-7-17(13)6-4-14-12/h4-7,11H,2-3,8-10H2,1H3/t11-/m1/s1
InChIKeyAXVYMCARKHYDBG-LLVKDONJSA-N
XLogP1.59
TPSA42.66 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.31
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine?
The IUPAC name of N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine (CID 164639712) is N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine.
What is the SMILES notation for N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine?
The canonical SMILES for N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine is CN(C[C@H]1CCCOC1)c1nccn2ccnc12.
What is the InChIKey of N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine?
The InChIKey is AXVYMCARKHYDBG-LLVKDONJSA-N. The full InChI is InChI=1S/C13H18N4O/c1-16(9-11-3-2-8-18-10-11)12-13-15-5-7-17(13)6-4-14-12/h4-7,11H,2-3,8-10H2,1H3/t11-/m1/s1.
What are the key properties of N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine?
N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine has a molecular weight of 246.31 g/mol, XLogP of 1.59, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[(3R)-oxan-3-yl]methyl]imidazo[1,2-a]pyrazin-8-amine is sourced from PubChem (CID 164639712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).