2H-cyclohepta[c]pyridin-4-ol

C10H9NO — CID 171853945

IUPAC2H-cyclohepta[c]pyridin-4-ol
SMILESOC1=CNC=C2C=CC=CC=C12
InChIInChI=1S/C10H9NO/c12-10-7-11-6-8-4-2-1-3-5-9(8)10/h1-7,11-12H
InChIKeyJQANMMCOZJIJAJ-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.93
Rot. Bonds

About 2H-cyclohepta[c]pyridin-4-ol

2H-cyclohepta[c]pyridin-4-ol (PubChem CID 171853945) has the molecular formula C10H9NO and a molecular weight of 159.19 g/mol. Its IUPAC name is 2H-cyclohepta[c]pyridin-4-ol.

Molecular Properties

Compound Name2H-cyclohepta[c]pyridin-4-ol
PubChem CID171853945
Molecular FormulaC10H9NO
Molecular Weight159.19 g/mol
Exact Mass159.07
IUPAC Name2H-cyclohepta[c]pyridin-4-ol
SMILESOC1=CNC=C2C=CC=CC=C12
InChIInChI=1S/C10H9NO/c12-10-7-11-6-8-4-2-1-3-5-9(8)10/h1-7,11-12H
InChIKeyJQANMMCOZJIJAJ-UHFFFAOYSA-N
XLogP1.93
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2H-2-benzazepin-6-ol
CID 18004599
5-Hydroxycyclohepta[1,2-c]pyridine
CID 21276159
(6-ethyl-1H-azepin-4-yl)methanol
CID 70472240
(3-methyl-1H-azepin-4-yl)methanol
CID 70473243
2H-2-benzazepin-4-ol
CID 87766208
1-(1H-azepin-4-yl)ethanol
CID 89156860
2,3-Dihydroisoquinolin-5-ol
CID 91247829
1-(1H-azepin-4-yl)butan-1-ol
CID 139729817
2H-2-benzazepin-6-ol;hydrobromide
CID 141074641
5-Azatricyclo[9.4.0.03,8]pentadeca-1,3(8),6,10,12,14-hexaen-9-ol
CID 141851696
1-(4-Methyl-1,2-dihydropyridin-5-yl)ethenol
CID 145471802
2H-2-benzazepin-5-ol
CID 154081445

Frequently Asked Questions

What is the IUPAC name of 2H-cyclohepta[c]pyridin-4-ol?
The IUPAC name of 2H-cyclohepta[c]pyridin-4-ol (CID 171853945) is 2H-cyclohepta[c]pyridin-4-ol.
What is the SMILES notation for 2H-cyclohepta[c]pyridin-4-ol?
The canonical SMILES for 2H-cyclohepta[c]pyridin-4-ol is OC1=CNC=C2C=CC=CC=C12.
What is the InChIKey of 2H-cyclohepta[c]pyridin-4-ol?
The InChIKey is JQANMMCOZJIJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO/c12-10-7-11-6-8-4-2-1-3-5-9(8)10/h1-7,11-12H.
What are the key properties of 2H-cyclohepta[c]pyridin-4-ol?
2H-cyclohepta[c]pyridin-4-ol has a molecular weight of 159.19 g/mol, XLogP of 1.93, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2H-cyclohepta[c]pyridin-4-ol is sourced from PubChem (CID 171853945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).