3a,4-dihydro-3H-imidazo[1,5-a]indole

C10H10N2 — CID 90860060

IUPAC3a,4-dihydro-3H-imidazo[1,5-a]indole
SMILESC1=NCC2Cc3ccccc3N12
InChIInChI=1S/C10H10N2/c1-2-4-10-8(3-1)5-9-6-11-7-12(9)10/h1-4,7,9H,5-6H2
InChIKeyDDVGCHLNCRFCFH-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.46
Rot. Bonds

About 3a,4-dihydro-3H-imidazo[1,5-a]indole

3a,4-dihydro-3H-imidazo[1,5-a]indole (PubChem CID 90860060) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 3a,4-dihydro-3H-imidazo[1,5-a]indole.

Molecular Properties

Compound Name3a,4-dihydro-3H-imidazo[1,5-a]indole
PubChem CID90860060
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name3a,4-dihydro-3H-imidazo[1,5-a]indole
SMILESC1=NCC2Cc3ccccc3N12
InChIInChI=1S/C10H10N2/c1-2-4-10-8(3-1)5-9-6-11-7-12(9)10/h1-4,7,9H,5-6H2
InChIKeyDDVGCHLNCRFCFH-UHFFFAOYSA-N
XLogP1.46
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.20
LogP ≤ 51.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-Methyl-2,3-dihydro-1H-indole
CID 55830
2-(4,5-dihydro-1H-imidazol-2-yl)-1-methyl-2,3-dihydroindole
CID 10219857
2-(4,5-dihydro-1H-imidazol-2-yl)-1-prop-2-enyl-2,3-dihydroindole
CID 13473021
2-(4,5-Dihydro-1H-imidazol-2-yl)-1-ethyl-2,3-dihydro-1H-indole
CID 13869744
2-(4,5-Dihydro-1H-imidazol-2-yl)-5-fluoro-1-methyl-2,3-dihydro-1H-indole
CID 13869749
2,3-Dihydro-indole-1-carboxamidine
CID 12253764
2-(4,5-Dihydro-1H-imidazol-2-yl)-1-propyl-2,3-dihydro-1H-indole
CID 13473017
9-butyl-2-phenyl-2,9-dihydro-3H-imidazo[1,2-a]benzimidazole
CID 23723094
2-(2,3-dihydroindol-1-yl)-N,N-dimethylethanamine
CID 744368
1-benzyl-2-(4,5-dihydro-1H-imidazol-2-yl)-2,3-dihydroindole
CID 13389366
1-butyl-2-(4,5-dihydro-1H-imidazol-2-yl)-2,3-dihydroindole
CID 13473015
2,3-Dihydro-2-(4,5-dihydroimidazol-2-yl)-1-phenylindole
CID 13715489

Frequently Asked Questions

What is the IUPAC name of 3a,4-dihydro-3H-imidazo[1,5-a]indole?
The IUPAC name of 3a,4-dihydro-3H-imidazo[1,5-a]indole (CID 90860060) is 3a,4-dihydro-3H-imidazo[1,5-a]indole.
What is the SMILES notation for 3a,4-dihydro-3H-imidazo[1,5-a]indole?
The canonical SMILES for 3a,4-dihydro-3H-imidazo[1,5-a]indole is C1=NCC2Cc3ccccc3N12.
What is the InChIKey of 3a,4-dihydro-3H-imidazo[1,5-a]indole?
The InChIKey is DDVGCHLNCRFCFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-2-4-10-8(3-1)5-9-6-11-7-12(9)10/h1-4,7,9H,5-6H2.
What are the key properties of 3a,4-dihydro-3H-imidazo[1,5-a]indole?
3a,4-dihydro-3H-imidazo[1,5-a]indole has a molecular weight of 158.20 g/mol, XLogP of 1.46, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3a,4-dihydro-3H-imidazo[1,5-a]indole is sourced from PubChem (CID 90860060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).