1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol

C10H11F2NO — CID 112575643

IUPAC1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol
SMILESOC(C(F)F)C1CCc2cccnc21
InChIInChI=1S/C10H11F2NO/c11-10(12)9(14)7-4-3-6-2-1-5-13-8(6)7/h1-2,5,7,9-10,14H,3-4H2
InChIKeyAPJSXKUPOJQBCE-UHFFFAOYSA-N
MW199.20 g/mol
LogP1.74
Rot. Bonds2

About 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol (PubChem CID 112575643) has the molecular formula C10H11F2NO and a molecular weight of 199.20 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol
PubChem CID112575643
Molecular FormulaC10H11F2NO
Molecular Weight199.20 g/mol
Exact Mass199.08
IUPAC Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol
SMILESOC(C(F)F)C1CCc2cccnc21
InChIInChI=1S/C10H11F2NO/c11-10(12)9(14)7-4-3-6-2-1-5-13-8(6)7/h1-2,5,7,9-10,14H,3-4H2
InChIKeyAPJSXKUPOJQBCE-UHFFFAOYSA-N
XLogP1.74
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.20
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethyl]hydrazine
CID 105265157
6-bicyclo[3.1.0]hexanyl(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)methanol
CID 115819421
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(3,4,5-trifluorophenyl)methanol
CID 79739398
7-[fluoro(piperidin-4-yl)methyl]-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 112563875
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(5-methylfuran-2-yl)methanol
CID 79740317
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-pyridin-4-ylethanol
CID 79745519
1-(5,6,7,8-tetrahydroquinolin-8-yl)ethanol
CID 79739208
2-(2,3-difluorophenyl)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)ethanol
CID 115819425
2-(3,4-difluorophenyl)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)ethanol
CID 115819396
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-[5-(trifluoromethyl)-2-pyridinyl]methanol
CID 105112544
6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl-(2,6-dimethoxyphenyl)methanol
CID 115819406
2-(4-bromophenyl)-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)ethanol
CID 79746206

Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol?
The IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol (CID 112575643) is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol.
What is the SMILES notation for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol?
The canonical SMILES for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol is OC(C(F)F)C1CCc2cccnc21.
What is the InChIKey of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol?
The InChIKey is APJSXKUPOJQBCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F2NO/c11-10(12)9(14)7-4-3-6-2-1-5-13-8(6)7/h1-2,5,7,9-10,14H,3-4H2.
What are the key properties of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol?
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol has a molecular weight of 199.20 g/mol, XLogP of 1.74, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2,2-difluoroethanol is sourced from PubChem (CID 112575643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).