2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid

C10H11N3O2 — CID 83832770

IUPAC2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid
SMILESCCc1nc2ncccn2c1CC(=O)O
InChIInChI=1S/C10H11N3O2/c1-2-7-8(6-9(14)15)13-5-3-4-11-10(13)12-7/h3-5H,2,6H2,1H3,(H,14,15)
InChIKeyDWTPARABYTWUTC-UHFFFAOYSA-N
MW205.22 g/mol
LogP0.92
Rot. Bonds3

About 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid

2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid (PubChem CID 83832770) has the molecular formula C10H11N3O2 and a molecular weight of 205.22 g/mol. Its IUPAC name is 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid.

Molecular Properties

Compound Name2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid
PubChem CID83832770
Molecular FormulaC10H11N3O2
Molecular Weight205.22 g/mol
Exact Mass205.09
IUPAC Name2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid
SMILESCCc1nc2ncccn2c1CC(=O)O
InChIInChI=1S/C10H11N3O2/c1-2-7-8(6-9(14)15)13-5-3-4-11-10(13)12-7/h3-5H,2,6H2,1H3,(H,14,15)
InChIKeyDWTPARABYTWUTC-UHFFFAOYSA-N
XLogP0.92
TPSA67.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.22
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-propan-2-ylimidazo[1,2-a]pyrimidin-3-yl)acetic acid
CID 83837011
2-[2-(4-methylphenyl)imidazo[1,2-a]pyrimidin-3-yl]acetic acid
CID 82304788
2-propylimidazo[1,2-a]pyrimidine-3-carboxylic acid
CID 115405202
3-ethylsulfonylimidazo[1,2-a]pyrimidine-2-carboxylic acid
CID 156889877
2-methylimidazo[1,2-a]pyrimidine-3-carboxylic acid;hydrochloride
CID 155291153
N-[(3-bromoimidazo[1,2-a]pyrimidin-2-yl)methyl]-N-ethylethanamine
CID 5008895
2-ethyl-1-imidazo[1,2-a]pyrimidin-3-ylbutan-1-one
CID 166942027
2-(2-tert-butylimidazo[1,2-a]pyridin-3-yl)acetic acid
CID 82055184
2-bromo-1-(3-methylimidazo[1,2-a]pyrimidin-2-yl)ethanone
CID 155423157
2-(3-ethylimidazo[1,5-a]pyridin-1-yl)acetic acid
CID 28797830
N-methyl-1-(2-methylimidazo[1,2-a]pyrimidin-3-yl)methanamine
CID 83827625
2-[2-(3-ethyl-2-pyridinyl)-4,6-dimethylpyrimidin-5-yl]acetic acid
CID 82740850

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid?
The IUPAC name of 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid (CID 83832770) is 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid.
What is the SMILES notation for 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid?
The canonical SMILES for 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid is CCc1nc2ncccn2c1CC(=O)O.
What is the InChIKey of 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid?
The InChIKey is DWTPARABYTWUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3O2/c1-2-7-8(6-9(14)15)13-5-3-4-11-10(13)12-7/h3-5H,2,6H2,1H3,(H,14,15).
What are the key properties of 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid?
2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid has a molecular weight of 205.22 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazo[1,2-a]pyrimidin-3-yl)acetic acid is sourced from PubChem (CID 83832770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).