1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one

C10H9N3O — CID 83137788

IUPAC1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one
SMILESNC1=NC(=O)C2Cc3ccccc3N12
InChIInChI=1S/C10H9N3O/c11-10-12-9(14)8-5-6-3-1-2-4-7(6)13(8)10/h1-4,8H,5H2,(H2,11,12,14)
InChIKeyPYBZITXHBCGBMS-UHFFFAOYSA-N
MW187.20 g/mol
LogP0.27
Rot. Bonds

About 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one

1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one (PubChem CID 83137788) has the molecular formula C10H9N3O and a molecular weight of 187.20 g/mol. Its IUPAC name is 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one.

Molecular Properties

Compound Name1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one
PubChem CID83137788
Molecular FormulaC10H9N3O
Molecular Weight187.20 g/mol
Exact Mass187.07
IUPAC Name1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one
SMILESNC1=NC(=O)C2Cc3ccccc3N12
InChIInChI=1S/C10H9N3O/c11-10-12-9(14)8-5-6-3-1-2-4-7(6)13(8)10/h1-4,8H,5H2,(H2,11,12,14)
InChIKeyPYBZITXHBCGBMS-UHFFFAOYSA-N
XLogP0.27
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.20
LogP ≤ 50.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-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

2-cyclopropyl-3a,4-dihydroimidazo[1,5-a]indole-1,3-dione
CID 62699680
1,5,8-triazatetracyclo[8.7.0.02,7.012,17]heptadeca-2(7),3,5,12,14,16-hexaen-9-one
CID 79291073
1,11,12,13-tetrazatetracyclo[7.6.0.02,7.010,14]pentadeca-2,4,6,10,13-pentaen-15-one
CID 68562714
2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine
CID 3241
3-chloro-1-hydroxy-3,4-dihydroquinolin-2-one
CID 13220468
1,2,3a,4-tetrahydropyrrolo[1,2-a]indol-3-one
CID 167313251
(6R)-2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-3-amine;hydrochloride
CID 15629773
2,4-difluoro-6a,7-dihydro-5H-indolo[1,2-a]quinoxalin-6-one
CID 115510050
2-phenyl-3a,4-dihydro-3H-imidazo[1,5-a]indol-1-one
CID 102083892
(9R,9aR)-9-methyl-9a,10-dihydro-9H-pyrido[1,2-a]indol-6-one
CID 102526166
4-chloro-6-(2-methyl-2,3-dihydroindol-1-yl)-1,3,5-triazin-2-amine
CID 80754131
3-amino-2,4-diazatetracyclo[12.4.0.02,6.07,12]octadeca-1(18),3,7,9,11,14,16-heptaen-13-one
CID 71306710

Frequently Asked Questions

What is the IUPAC name of 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one?
The IUPAC name of 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one (CID 83137788) is 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one.
What is the SMILES notation for 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one?
The canonical SMILES for 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one is NC1=NC(=O)C2Cc3ccccc3N12.
What is the InChIKey of 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one?
The InChIKey is PYBZITXHBCGBMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3O/c11-10-12-9(14)8-5-6-3-1-2-4-7(6)13(8)10/h1-4,8H,5H2,(H2,11,12,14).
What are the key properties of 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one?
1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one has a molecular weight of 187.20 g/mol, XLogP of 0.27, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3a,4-dihydroimidazo[1,5-a]indol-3-one is sourced from PubChem (CID 83137788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).