2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine

C12H17N3 — CID 155732928

IUPAC2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine
SMILESCCc1cn2c(C(C)C)cc(C)nc2n1
InChIInChI=1S/C12H17N3/c1-5-10-7-15-11(8(2)3)6-9(4)13-12(15)14-10/h6-8H,5H2,1-4H3
InChIKeyUWYVOXUSZIFACO-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.72
Rot. Bonds2

About 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine

2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine (PubChem CID 155732928) has the molecular formula C12H17N3 and a molecular weight of 203.29 g/mol. Its IUPAC name is 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine
PubChem CID155732928
Molecular FormulaC12H17N3
Molecular Weight203.29 g/mol
Exact Mass203.14
IUPAC Name2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine
SMILESCCc1cn2c(C(C)C)cc(C)nc2n1
InChIInChI=1S/C12H17N3/c1-5-10-7-15-11(8(2)3)6-9(4)13-12(15)14-10/h6-8H,5H2,1-4H3
InChIKeyUWYVOXUSZIFACO-UHFFFAOYSA-N
XLogP2.72
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine (CID 155732928) is 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine is CCc1cn2c(C(C)C)cc(C)nc2n1.
What is the InChIKey of 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine?
The InChIKey is UWYVOXUSZIFACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3/c1-5-10-7-15-11(8(2)3)6-9(4)13-12(15)14-10/h6-8H,5H2,1-4H3.
What are the key properties of 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine?
2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine has a molecular weight of 203.29 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-7-methyl-5-propan-2-ylimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 155732928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).