6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one

C11H16N4O — CID 82616358

IUPAC6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(C)n2c(=O)c(CCN)cnc2n1C
InChIInChI=1S/C11H16N4O/c1-7-8(2)15-10(16)9(4-5-12)6-13-11(15)14(7)3/h6H,4-5,12H2,1-3H3
InChIKeySYRGDLWZARXVTN-UHFFFAOYSA-N
MW220.28 g/mol
LogP0.15
Rot. Bonds2

About 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one

6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one (PubChem CID 82616358) has the molecular formula C11H16N4O and a molecular weight of 220.28 g/mol. Its IUPAC name is 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one.

Molecular Properties

Compound Name6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one
PubChem CID82616358
Molecular FormulaC11H16N4O
Molecular Weight220.28 g/mol
Exact Mass220.13
IUPAC Name6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one
SMILESCc1c(C)n2c(=O)c(CCN)cnc2n1C
InChIInChI=1S/C11H16N4O/c1-7-8(2)15-10(16)9(4-5-12)6-13-11(15)14(7)3/h6H,4-5,12H2,1-3H3
InChIKeySYRGDLWZARXVTN-UHFFFAOYSA-N
XLogP0.15
TPSA65.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.28
LogP ≤ 50.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one?
The IUPAC name of 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one (CID 82616358) is 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one.
What is the SMILES notation for 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one?
The canonical SMILES for 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one is Cc1c(C)n2c(=O)c(CCN)cnc2n1C.
What is the InChIKey of 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one?
The InChIKey is SYRGDLWZARXVTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O/c1-7-8(2)15-10(16)9(4-5-12)6-13-11(15)14(7)3/h6H,4-5,12H2,1-3H3.
What are the key properties of 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one?
6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one has a molecular weight of 220.28 g/mol, XLogP of 0.15, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminoethyl)-1,2,3-trimethylimidazo[1,2-a]pyrimidin-5-one is sourced from PubChem (CID 82616358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).