4,6,7,7a-tetrahydropyrrolo[2,3-f]indole

C10H10N2 — CID 57008412

IUPAC4,6,7,7a-tetrahydropyrrolo[2,3-f]indole
SMILESC1=NC2=CC3CCN=C3CC2=C1
InChIInChI=1S/C10H10N2/c1-3-11-9-6-8-2-4-12-10(8)5-7(1)9/h1,3,6,8H,2,4-5H2
InChIKeyFLCDGPGTZACHMS-UHFFFAOYSA-N
MW158.20 g/mol
LogP1.75
Rot. Bonds

About 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole

4,6,7,7a-tetrahydropyrrolo[2,3-f]indole (PubChem CID 57008412) has the molecular formula C10H10N2 and a molecular weight of 158.20 g/mol. Its IUPAC name is 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole.

Molecular Properties

Compound Name4,6,7,7a-tetrahydropyrrolo[2,3-f]indole
PubChem CID57008412
Molecular FormulaC10H10N2
Molecular Weight158.20 g/mol
Exact Mass158.08
IUPAC Name4,6,7,7a-tetrahydropyrrolo[2,3-f]indole
SMILESC1=NC2=CC3CCN=C3CC2=C1
InChIInChI=1S/C10H10N2/c1-3-11-9-6-8-2-4-12-10(8)5-7(1)9/h1,3,6,8H,2,4-5H2
InChIKeyFLCDGPGTZACHMS-UHFFFAOYSA-N
XLogP1.75
TPSA24.72 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 ≤ 51.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Pyrrolo[3,4-c]carbazole
CID 21887285
Cetylpyrroloindole
CID 129796268
Dihydroindolo[4,5-e]indole
CID 129873830
6,8,9,10,10a,10b-Hexahydroindolo[4,3-fg]quinoline
CID 54016915
5,6-Dihydroindol-4-imine
CID 57269353
2,3-Dimethyl-2,3-dihydropyrrolo[2,3-f]indole
CID 70084835
3,11-Diazatetracyclo[8.5.0.02,7.04,6]pentadeca-1(15),2,4(6),7,9,11,13-heptaene
CID 88446790
5-Tert-butyl-4,5-dihydroindol-6-imine
CID 123798017
(4Z)-4-(cyclohexylmethylidene)-6aH-pyrrolo[3,4-c]pyrrole
CID 123802175
2-Cyclohexa-2,4-dien-1-ylpyrrolo[2,3-g][1]benzazepine
CID 141516838
4,5,6,7-Tetrahydrocyclopenta[f]indole
CID 141834442
9-ethyl-9H-pyrido[3,2-b]indole
CID 142740001

Frequently Asked Questions

What is the IUPAC name of 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole?
The IUPAC name of 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole (CID 57008412) is 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole.
What is the SMILES notation for 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole?
The canonical SMILES for 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole is C1=NC2=CC3CCN=C3CC2=C1.
What is the InChIKey of 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole?
The InChIKey is FLCDGPGTZACHMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2/c1-3-11-9-6-8-2-4-12-10(8)5-7(1)9/h1,3,6,8H,2,4-5H2.
What are the key properties of 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole?
4,6,7,7a-tetrahydropyrrolo[2,3-f]indole has a molecular weight of 158.20 g/mol, XLogP of 1.75, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6,7,7a-tetrahydropyrrolo[2,3-f]indole is sourced from PubChem (CID 57008412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).