1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol

C13H19NO — CID 79738601

IUPAC1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol
SMILESCCC(O)CCC1CCc2cccnc21
InChIInChI=1S/C13H19NO/c1-2-12(15)8-7-11-6-5-10-4-3-9-14-13(10)11/h3-4,9,11-12,15H,2,5-8H2,1H3
InChIKeyUEIRDIBLLROMQR-UHFFFAOYSA-N
MW205.30 g/mol
LogP2.66
Rot. Bonds4

About 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol

1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol (PubChem CID 79738601) has the molecular formula C13H19NO and a molecular weight of 205.30 g/mol. Its IUPAC name is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol.

Molecular Properties

Compound Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol
PubChem CID79738601
Molecular FormulaC13H19NO
Molecular Weight205.30 g/mol
Exact Mass205.15
IUPAC Name1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol
SMILESCCC(O)CCC1CCc2cccnc21
InChIInChI=1S/C13H19NO/c1-2-12(15)8-7-11-6-5-10-4-3-9-14-13(10)11/h3-4,9,11-12,15H,2,5-8H2,1H3
InChIKeyUEIRDIBLLROMQR-UHFFFAOYSA-N
XLogP2.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.30
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol?
The IUPAC name of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol (CID 79738601) is 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol.
What is the SMILES notation for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol?
The canonical SMILES for 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol is CCC(O)CCC1CCc2cccnc21.
What is the InChIKey of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol?
The InChIKey is UEIRDIBLLROMQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO/c1-2-12(15)8-7-11-6-5-10-4-3-9-14-13(10)11/h3-4,9,11-12,15H,2,5-8H2,1H3.
What are the key properties of 1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol?
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)pentan-3-ol has a molecular weight of 205.30 g/mol, XLogP of 2.66, 4 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)pentan-3-ol is sourced from PubChem (CID 79738601), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).