(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol

C16H15NO — CID 135017650

IUPAC(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol
SMILESO[C@@]12CNc3ccccc3[C@@H]1c1ccccc1C2
InChIInChI=1S/C16H15NO/c18-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)17-10-16/h1-8,15,17-18H,9-10H2/t15-,16-/m0/s1
InChIKeyDUJGZZGYAYCEGP-HOTGVXAUSA-N
MW237.30 g/mol
LogP2.53
Rot. Bonds

About (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol

(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol (PubChem CID 135017650) has the molecular formula C16H15NO and a molecular weight of 237.30 g/mol. Its IUPAC name is (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol.

Molecular Properties

Compound Name(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol
PubChem CID135017650
Molecular FormulaC16H15NO
Molecular Weight237.30 g/mol
Exact Mass237.12
IUPAC Name(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol
SMILESO[C@@]12CNc3ccccc3[C@@H]1c1ccccc1C2
InChIInChI=1S/C16H15NO/c18-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)17-10-16/h1-8,15,17-18H,9-10H2/t15-,16-/m0/s1
InChIKeyDUJGZZGYAYCEGP-HOTGVXAUSA-N
XLogP2.53
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(6aR,11bR)-7,11b-dihydro-6H-indeno[2,1-c]chromen-6a-ol
CID 166953593
(3R)-2,3-dihydro-1H-indol-3-ol
CID 67667878
1-bromo-2-methyl-1,3-dihydroinden-2-ol
CID 174888924
(2R,2aR,7aR)-7a-hydroxy-1,2,2a,7-tetrahydrocyclobuta[a]indene-2-carbonitrile
CID 10241516
(5R)-6,11-dihydro-5H-benzo[b][1]benzazepin-5-ol
CID 86312420
7,11b-dihydro-6H-indeno[2,1-c]chromene-4,6a,9-triol
CID 126663213
(1S,2S)-1-hydroxyspiro[1,3-dihydroindene-2,3'-1H-indole]-2'-one
CID 134951476
spiro[1,3-dihydroindene-2,1'-cyclopropane]-1-ol
CID 13300016
2,2-dimethyl-1,3-dihydroinden-1-amine
CID 22175144
1,2,7,7a-tetrahydrocyclopropa[b]naphthalen-1a-ol
CID 11789506
6,11-dihydro-5H-pyrido[4,3-c][1]benzazepin-11-ol
CID 70399337
(1R)-N'-hydroxy-1,3,3-trimethyl-1,4-dihydroisoquinoline-2-carboximidamide
CID 125483571

Frequently Asked Questions

What is the IUPAC name of (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol?
The IUPAC name of (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol (CID 135017650) is (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol.
What is the SMILES notation for (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol?
The canonical SMILES for (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol is O[C@@]12CNc3ccccc3[C@@H]1c1ccccc1C2.
What is the InChIKey of (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol?
The InChIKey is DUJGZZGYAYCEGP-HOTGVXAUSA-N. The full InChI is InChI=1S/C16H15NO/c18-16-9-11-5-1-2-6-12(11)15(16)13-7-3-4-8-14(13)17-10-16/h1-8,15,17-18H,9-10H2/t15-,16-/m0/s1.
What are the key properties of (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol?
(6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol has a molecular weight of 237.30 g/mol, XLogP of 2.53, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (6aR,11bS)-5,6,7,11b-tetrahydroindeno[2,1-c]quinolin-6a-ol is sourced from PubChem (CID 135017650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).