(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol

C10H13NO — CID 138752407

IUPAC(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol
SMILESO[C@H]1CCCCc2ncccc21
InChIInChI=1S/C10H13NO/c12-10-6-2-1-5-9-8(10)4-3-7-11-9/h3-4,7,10,12H,1-2,5-6H2/t10-/m0/s1
InChIKeyAMUSCQWNRWEJGB-JTQLQIEISA-N
MW163.22 g/mol
LogP1.84
Rot. Bonds

About (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol

(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol (PubChem CID 138752407) has the molecular formula C10H13NO and a molecular weight of 163.22 g/mol. Its IUPAC name is (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol.

Molecular Properties

Compound Name(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol
PubChem CID138752407
Molecular FormulaC10H13NO
Molecular Weight163.22 g/mol
Exact Mass163.10
IUPAC Name(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol
SMILESO[C@H]1CCCCc2ncccc21
InChIInChI=1S/C10H13NO/c12-10-6-2-1-5-9-8(10)4-3-7-11-9/h3-4,7,10,12H,1-2,5-6H2/t10-/m0/s1
InChIKeyAMUSCQWNRWEJGB-JTQLQIEISA-N
XLogP1.84
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.22
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5,6,7,8-tetrahydroquinoline-5-carbaldehyde
CID 174393645
5,6,7,8-tetrahydroquinolin-5-ylhydrazine
CID 53418196
(5R)-5,6,7,8,9,10-hexahydrobenzo[8]annulen-5-ol
CID 130614926
(5R)-5-(4-fluorophenyl)-5,6,7,8-tetrahydroquinoline
CID 91258411
(8S)-5,6,7,8-tetrahydroquinolin-8-ol
CID 11480532
N-propan-2-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-5-amine
CID 176861627
12-azabicyclo[9.4.0]pentadeca-1(11),12,14-triene
CID 175984451
ethyl 5,6,7,8-tetrahydroquinoline-5-carboxylate
CID 134691870
5-propan-2-yl-6,7,8,9-tetrahydro-5H-pyrido[3,2-c]azepine
CID 132509001
1,2,3,4-tetrahydronaphthalen-1-ol
CID 10723
6,7-dihydro-5H-pyrrolo[3,4-b]pyridin-5-ol
CID 155004666
(5S)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-ol;6,7-dihydrocyclopenta[b]pyridin-5-one;2-[(5R)-6,7-dihydro-5H-cyclopenta[b]pyridin-5-yl]isoindole-1,3-dione;2-[(5R)-1-oxido-6,7-dihydro-5H-cyclopenta[b]pyridin-1-ium-5-yl]isoindole-1,3-dione
CID 158982823

Frequently Asked Questions

What is the IUPAC name of (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol?
The IUPAC name of (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol (CID 138752407) is (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol.
What is the SMILES notation for (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol?
The canonical SMILES for (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol is O[C@H]1CCCCc2ncccc21.
What is the InChIKey of (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol?
The InChIKey is AMUSCQWNRWEJGB-JTQLQIEISA-N. The full InChI is InChI=1S/C10H13NO/c12-10-6-2-1-5-9-8(10)4-3-7-11-9/h3-4,7,10,12H,1-2,5-6H2/t10-/m0/s1.
What are the key properties of (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol?
(5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol has a molecular weight of 163.22 g/mol, XLogP of 1.84, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-6,7,8,9-tetrahydro-5H-cyclohepta[b]pyridin-5-ol is sourced from PubChem (CID 138752407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).