2-propan-2-yloxyimidazo[1,2-a]pyrimidine

C9H11N3O — CID 167420118

IUPAC2-propan-2-yloxyimidazo[1,2-a]pyrimidine
SMILESCC(C)Oc1cn2cccnc2n1
InChIInChI=1S/C9H11N3O/c1-7(2)13-8-6-12-5-3-4-10-9(12)11-8/h3-7H,1-2H3
InChIKeyYVVASJAQVPJGLH-UHFFFAOYSA-N
MW177.21 g/mol
LogP1.52
Rot. Bonds2

About 2-propan-2-yloxyimidazo[1,2-a]pyrimidine

2-propan-2-yloxyimidazo[1,2-a]pyrimidine (PubChem CID 167420118) has the molecular formula C9H11N3O and a molecular weight of 177.21 g/mol. Its IUPAC name is 2-propan-2-yloxyimidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-propan-2-yloxyimidazo[1,2-a]pyrimidine
PubChem CID167420118
Molecular FormulaC9H11N3O
Molecular Weight177.21 g/mol
Exact Mass177.09
IUPAC Name2-propan-2-yloxyimidazo[1,2-a]pyrimidine
SMILESCC(C)Oc1cn2cccnc2n1
InChIInChI=1S/C9H11N3O/c1-7(2)13-8-6-12-5-3-4-10-9(12)11-8/h3-7H,1-2H3
InChIKeyYVVASJAQVPJGLH-UHFFFAOYSA-N
XLogP1.52
TPSA39.42 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.21
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloroimidazo[1,2-a]pyrimidine
CID 14517580
2-propan-2-yloxyimidazo[1,2-a]pyrazine
CID 167420274
2-pyridin-2-ylimidazo[1,2-a]pyrimidine
CID 70500058
3-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanyl)butan-1-amine
CID 66228154
ethane;bis(imidazo[1,2-a]pyrimidine)
CID 161252419
2-(imidazo[1,2-a]pyrimidin-2-ylmethylsulfanyl)aniline
CID 693030
N-propan-2-yl-N-(pyridin-2-ylmethyl)imidazo[1,2-a]pyrimidine-2-carboxamide
CID 51090689
2-(3,5-difluorophenyl)imidazo[1,2-a]pyrimidine
CID 113303129
7-propan-2-yloxy-N-pyrazolo[1,5-a]pyrimidin-3-ylimidazo[1,2-a]pyrimidine-6-carboxamide;7-propan-2-yloxy-N-pyridin-2-ylimidazo[1,2-a]pyrimidine-6-carboxamide
CID 166472411
ethane;2-propan-2-yloxypyrimidine
CID 159788973
(3R)-1-(imidazo[1,2-a]pyrimidin-2-ylmethyl)-3-methyl-3-(2-methylpropyl)pyrrolidine-2,5-dione
CID 129402871
pyrimido[1,2-a]pyrimidin-2-one
CID 13114303

Frequently Asked Questions

What is the IUPAC name of 2-propan-2-yloxyimidazo[1,2-a]pyrimidine?
The IUPAC name of 2-propan-2-yloxyimidazo[1,2-a]pyrimidine (CID 167420118) is 2-propan-2-yloxyimidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-propan-2-yloxyimidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-propan-2-yloxyimidazo[1,2-a]pyrimidine is CC(C)Oc1cn2cccnc2n1.
What is the InChIKey of 2-propan-2-yloxyimidazo[1,2-a]pyrimidine?
The InChIKey is YVVASJAQVPJGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O/c1-7(2)13-8-6-12-5-3-4-10-9(12)11-8/h3-7H,1-2H3.
What are the key properties of 2-propan-2-yloxyimidazo[1,2-a]pyrimidine?
2-propan-2-yloxyimidazo[1,2-a]pyrimidine has a molecular weight of 177.21 g/mol, XLogP of 1.52, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-propan-2-yloxyimidazo[1,2-a]pyrimidine is sourced from PubChem (CID 167420118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).