4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol

C15H16N2O — CID 123663983

IUPAC4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol
SMILESOCC1C=C2c3cccc4[nH]cc(c34)CC2NC1
InChIInChI=1S/C15H16N2O/c18-8-9-4-12-11-2-1-3-13-15(11)10(7-17-13)5-14(12)16-6-9/h1-4,7,9,14,16-18H,5-6,8H2
InChIKeyIECDUHOPXGMRHI-UHFFFAOYSA-N
MW240.31 g/mol
LogP1.69
Rot. Bonds1

About 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol

4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol (PubChem CID 123663983) has the molecular formula C15H16N2O and a molecular weight of 240.31 g/mol. Its IUPAC name is 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol.

Molecular Properties

Compound Name4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol
PubChem CID123663983
Molecular FormulaC15H16N2O
Molecular Weight240.31 g/mol
Exact Mass240.13
IUPAC Name4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol
SMILESOCC1C=C2c3cccc4[nH]cc(c34)CC2NC1
InChIInChI=1S/C15H16N2O/c18-8-9-4-12-11-2-1-3-13-15(11)10(7-17-13)5-14(12)16-6-9/h1-4,7,9,14,16-18H,5-6,8H2
InChIKeyIECDUHOPXGMRHI-UHFFFAOYSA-N
XLogP1.69
TPSA48.05 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol 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

(6aR)-N,N-diethyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
CID 22294663
[(6aR,9S)-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-7-ium-9-yl]methanol
CID 7059542
3-[(6aR,9S)-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-yl]-1,1-diethylurea
CID 15745469
(6aR,9R)-N-[3-(dimethylamino)propoxy]-N-propan-2-yl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
CID 167428238
(6aR)-9-ethyl-7-methyl-4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-7-ium
CID 172577988
(6aR)-9-(iodomethyl)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline
CID 166091886
(6aR,9S)-7-ethyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-amine
CID 70392867
1-[(4S,7R)-11-azatetracyclo[7.6.1.02,7.012,16]hexadeca-1(16),2,9,12,14-pentaen-4-yl]ethanone
CID 122549277
[(6aR,9R)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]methylurea
CID 70390159
(2S,3R,4S,5R,6R)-2-[[(6aR)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]methoxy]-6-(hydroxymethyl)oxane-3,4,5-triol
CID 10645557
2-[(6aR)-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinolin-9-yl]-N,N-diethylacetamide
CID 159746240
(6aR,9R)-7-methyl-9-(phenylsulfanylmethyl)-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline
CID 14107774

Frequently Asked Questions

What is the IUPAC name of 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol?
The IUPAC name of 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol (CID 123663983) is 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol.
What is the SMILES notation for 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol?
The canonical SMILES for 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol is OCC1C=C2c3cccc4[nH]cc(c34)CC2NC1.
What is the InChIKey of 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol?
The InChIKey is IECDUHOPXGMRHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O/c18-8-9-4-12-11-2-1-3-13-15(11)10(7-17-13)5-14(12)16-6-9/h1-4,7,9,14,16-18H,5-6,8H2.
What are the key properties of 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol?
4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol has a molecular weight of 240.31 g/mol, XLogP of 1.69, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6,6a,7,8,9-hexahydroindolo[4,3-fg]quinolin-9-ylmethanol is sourced from PubChem (CID 123663983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).