8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one

C9H12N2O — CID 82652363

IUPAC8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one
SMILESNCc1ccc(=O)n2c1CCC2
InChIInChI=1S/C9H12N2O/c10-6-7-3-4-9(12)11-5-1-2-8(7)11/h3-4H,1-2,5-6,10H2
InChIKeyUCSRJJLYTIRMSX-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.25
Rot. Bonds1

About 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one

8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one (PubChem CID 82652363) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one.

Molecular Properties

Compound Name8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one
PubChem CID82652363
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one
SMILESNCc1ccc(=O)n2c1CCC2
InChIInChI=1S/C9H12N2O/c10-6-7-3-4-9(12)11-5-1-2-8(7)11/h3-4H,1-2,5-6,10H2
InChIKeyUCSRJJLYTIRMSX-UHFFFAOYSA-N
XLogP0.25
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-(pyrrolidin-1-ylmethyl)-1H-pyridin-2-one
CID 135308034
6-methyl-1H,2H,3H,5H,6H-pyrrolo[2,3-c]pyridin-5-one
CID 71758441
2,3-Dihydroindolizin-5(1H)-one
CID 13616825
1-Acetyl-1,2,3,5-tetrahydro-6H-pyrrolo[3,2-c]pyridin-6-one
CID 3645068
1,2,3,5-Tetrahydroindolizine-7-carboxamide
CID 21255208
2,3-dihydro-1H-indolizin-1-id-5-one;yttrium
CID 58717463
1,2,3,5-Tetrahydroindolizine-8-carboxamide
CID 67554211
5-oxo-2,3-dihydro-1H-indolizine-8-carboxamide
CID 68467106
1,2,3,5-Tetrahydroindolizine-6-carboxamide
CID 70347407
7-amino-2,3-dihydro-1H-indolizin-5-one
CID 82417470
3,3,6-Trimethyl-1,2,3,6-tetrahydro-pyrrolo[2,3-c]pyridin-5-one
CID 86723979
6-Butyl-3,3-dimethyl-1,2-dihydropyrrolo[2,3-c]pyridin-5-one
CID 118169726

Frequently Asked Questions

What is the IUPAC name of 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one?
The IUPAC name of 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one (CID 82652363) is 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one.
What is the SMILES notation for 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one?
The canonical SMILES for 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one is NCc1ccc(=O)n2c1CCC2.
What is the InChIKey of 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one?
The InChIKey is UCSRJJLYTIRMSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c10-6-7-3-4-9(12)11-5-1-2-8(7)11/h3-4H,1-2,5-6,10H2.
What are the key properties of 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one?
8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one has a molecular weight of 164.21 g/mol, XLogP of 0.25, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(aminomethyl)-2,3-dihydro-1H-indolizin-5-one is sourced from PubChem (CID 82652363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).