2-amino-1-(6-methoxyindolizin-1-yl)ethanone

C11H12N2O2 — CID 169203261

IUPAC2-amino-1-(6-methoxyindolizin-1-yl)ethanone
SMILESCOc1ccc2c(C(=O)CN)ccn2c1
InChIInChI=1S/C11H12N2O2/c1-15-8-2-3-10-9(11(14)6-12)4-5-13(10)7-8/h2-5,7H,6,12H2,1H3
InChIKeyXSRBUYMOAAZOPR-UHFFFAOYSA-N
MW204.23 g/mol
LogP1.09
Rot. Bonds3

About 2-amino-1-(6-methoxyindolizin-1-yl)ethanone

2-amino-1-(6-methoxyindolizin-1-yl)ethanone (PubChem CID 169203261) has the molecular formula C11H12N2O2 and a molecular weight of 204.23 g/mol. Its IUPAC name is 2-amino-1-(6-methoxyindolizin-1-yl)ethanone.

Molecular Properties

Compound Name2-amino-1-(6-methoxyindolizin-1-yl)ethanone
PubChem CID169203261
Molecular FormulaC11H12N2O2
Molecular Weight204.23 g/mol
Exact Mass204.09
IUPAC Name2-amino-1-(6-methoxyindolizin-1-yl)ethanone
SMILESCOc1ccc2c(C(=O)CN)ccn2c1
InChIInChI=1S/C11H12N2O2/c1-15-8-2-3-10-9(11(14)6-12)4-5-13(10)7-8/h2-5,7H,6,12H2,1H3
InChIKeyXSRBUYMOAAZOPR-UHFFFAOYSA-N
XLogP1.09
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-2-amino-N-[2-(6-methoxyindolizin-1-yl)-2-oxoethyl]propanamide
CID 169203354
2-amino-1-(2-amino-4-methoxyphenyl)ethanone
CID 105438694
(2S)-2-amino-N-[1-(6-methoxyindolizin-1-yl)propan-2-yl]-N-methylpropanamide
CID 176624510
N-[2-(7-methoxyindolizin-1-yl)-2-oxoethyl]acetamide
CID 169203013
2-amino-1-(2-chloro-3-fluoro-5-methoxyphenyl)ethanone
CID 84785712
2-amino-1-(2-hydroxy-5-methoxy-3-methylphenyl)ethanone
CID 84665966
1-(6-methoxypyrazolo[1,5-a]pyridin-3-yl)ethanone
CID 118565994
2-(5-methoxyindol-1-yl)-1-(2-methylphenyl)ethanone
CID 62025582
6-methoxypyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 83680674
2-amino-1-(2-amino-3-methoxyphenyl)ethanone
CID 105438693
2-amino-1-(4-methoxy-2,6-dimethylphenyl)ethanone
CID 82048603
3-amino-1-(2,5-dimethoxyphenyl)propan-1-one
CID 10149089

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(6-methoxyindolizin-1-yl)ethanone?
The IUPAC name of 2-amino-1-(6-methoxyindolizin-1-yl)ethanone (CID 169203261) is 2-amino-1-(6-methoxyindolizin-1-yl)ethanone.
What is the SMILES notation for 2-amino-1-(6-methoxyindolizin-1-yl)ethanone?
The canonical SMILES for 2-amino-1-(6-methoxyindolizin-1-yl)ethanone is COc1ccc2c(C(=O)CN)ccn2c1.
What is the InChIKey of 2-amino-1-(6-methoxyindolizin-1-yl)ethanone?
The InChIKey is XSRBUYMOAAZOPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2O2/c1-15-8-2-3-10-9(11(14)6-12)4-5-13(10)7-8/h2-5,7H,6,12H2,1H3.
What are the key properties of 2-amino-1-(6-methoxyindolizin-1-yl)ethanone?
2-amino-1-(6-methoxyindolizin-1-yl)ethanone has a molecular weight of 204.23 g/mol, XLogP of 1.09, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(6-methoxyindolizin-1-yl)ethanone is sourced from PubChem (CID 169203261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).