1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one

C14H20N6O — CID 80839980

IUPAC1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one
SMILESCNc1cn2ccnc2c(N2CCN(C)C(=O)C2(C)C)n1
InChIInChI=1S/C14H20N6O/c1-14(2)13(21)18(4)7-8-20(14)12-11-16-5-6-19(11)9-10(15-3)17-12/h5-6,9,15H,7-8H2,1-4H3
InChIKeyFFUJGTDSMQRYJW-UHFFFAOYSA-N
MW288.36 g/mol
LogP0.83
Rot. Bonds2

About 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one

1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one (PubChem CID 80839980) has the molecular formula C14H20N6O and a molecular weight of 288.36 g/mol. Its IUPAC name is 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one.

Molecular Properties

Compound Name1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one
PubChem CID80839980
Molecular FormulaC14H20N6O
Molecular Weight288.36 g/mol
Exact Mass288.17
IUPAC Name1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one
SMILESCNc1cn2ccnc2c(N2CCN(C)C(=O)C2(C)C)n1
InChIInChI=1S/C14H20N6O/c1-14(2)13(21)18(4)7-8-20(14)12-11-16-5-6-19(11)9-10(15-3)17-12/h5-6,9,15H,7-8H2,1-4H3
InChIKeyFFUJGTDSMQRYJW-UHFFFAOYSA-N
XLogP0.83
TPSA65.77 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.36
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one?
The IUPAC name of 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one (CID 80839980) is 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one.
What is the SMILES notation for 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one?
The canonical SMILES for 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one is CNc1cn2ccnc2c(N2CCN(C)C(=O)C2(C)C)n1.
What is the InChIKey of 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one?
The InChIKey is FFUJGTDSMQRYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6O/c1-14(2)13(21)18(4)7-8-20(14)12-11-16-5-6-19(11)9-10(15-3)17-12/h5-6,9,15H,7-8H2,1-4H3.
What are the key properties of 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one?
1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one has a molecular weight of 288.36 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3-trimethyl-4-[6-(methylamino)imidazo[1,2-a]pyrazin-8-yl]piperazin-2-one is sourced from PubChem (CID 80839980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).