ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate

C11H17N3O2 — CID 83966461

IUPACethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate
SMILESCCOC(=O)Cc1cn2c(n1)C(N)CCC2
InChIInChI=1S/C11H17N3O2/c1-2-16-10(15)6-8-7-14-5-3-4-9(12)11(14)13-8/h7,9H,2-6,12H2,1H3
InChIKeySRNHHYYWKALSJH-UHFFFAOYSA-N
MW223.28 g/mol
LogP0.78
Rot. Bonds3

About ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate

ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate (PubChem CID 83966461) has the molecular formula C11H17N3O2 and a molecular weight of 223.28 g/mol. Its IUPAC name is ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate.

Molecular Properties

Compound Nameethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate
PubChem CID83966461
Molecular FormulaC11H17N3O2
Molecular Weight223.28 g/mol
Exact Mass223.13
IUPAC Nameethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate
SMILESCCOC(=O)Cc1cn2c(n1)C(N)CCC2
InChIInChI=1S/C11H17N3O2/c1-2-16-10(15)6-8-7-14-5-3-4-9(12)11(14)13-8/h7,9H,2-6,12H2,1H3
InChIKeySRNHHYYWKALSJH-UHFFFAOYSA-N
XLogP0.78
TPSA70.14 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 2-(6-amino-8-methyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate
CID 83966576
(2-ethyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl)methanamine
CID 83865580
2-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 117158133
2-[(1-propan-2-ylpiperidin-3-yl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 117158017
(8R)-2-cyclopropyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-amine
CID 96629769
2-(2,2-dimethylpropyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyridine-8-carboxylic acid
CID 117157283
ethyl 2-[2-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1,3-thiazol-4-yl]acetate
CID 80574451
ethyl 2-(2-cyclobutyl-1,3-thiazol-4-yl)acetate
CID 80573343
ethyl 2-[2-[(1-ethylpiperidin-4-yl)-methylamino]-1,3-thiazol-4-yl]acetate
CID 80574132
[2-[(2-methylphenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-8-yl]methanol
CID 117157483
ethyl 2-[2-(azepan-1-yl)-1,3-thiazol-4-yl]acetate
CID 80574155
ethyl 2-(2-cyclooctyl-1,3-thiazol-4-yl)acetate
CID 80602146

Frequently Asked Questions

What is the IUPAC name of ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate?
The IUPAC name of ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate (CID 83966461) is ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate.
What is the SMILES notation for ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate?
The canonical SMILES for ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate is CCOC(=O)Cc1cn2c(n1)C(N)CCC2.
What is the InChIKey of ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate?
The InChIKey is SRNHHYYWKALSJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O2/c1-2-16-10(15)6-8-7-14-5-3-4-9(12)11(14)13-8/h7,9H,2-6,12H2,1H3.
What are the key properties of ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate?
ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate has a molecular weight of 223.28 g/mol, XLogP of 0.78, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-(8-amino-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-2-yl)acetate is sourced from PubChem (CID 83966461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).