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

C14H19NO — CID 79746233

IUPAC1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol
SMILESCCC(O)(C1CC1)C1CCc2cccnc21
InChIInChI=1S/C14H19NO/c1-2-14(16,11-6-7-11)12-8-5-10-4-3-9-15-13(10)12/h3-4,9,11-12,16H,2,5-8H2,1H3
InChIKeyJFKIMDZBDOORJU-UHFFFAOYSA-N
MW217.31 g/mol
LogP2.66
Rot. Bonds3

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

1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol (PubChem CID 79746233) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol.

Molecular Properties

Compound Name1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol
PubChem CID79746233
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol
SMILESCCC(O)(C1CC1)C1CCc2cccnc21
InChIInChI=1S/C14H19NO/c1-2-14(16,11-6-7-11)12-8-5-10-4-3-9-15-13(10)12/h3-4,9,11-12,16H,2,5-8H2,1H3
InChIKeyJFKIMDZBDOORJU-UHFFFAOYSA-N
XLogP2.66
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
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-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol?
The IUPAC name of 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol (CID 79746233) is 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol.
What is the SMILES notation for 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol?
The canonical SMILES for 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol is CCC(O)(C1CC1)C1CCc2cccnc21.
What is the InChIKey of 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol?
The InChIKey is JFKIMDZBDOORJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-2-14(16,11-6-7-11)12-8-5-10-4-3-9-15-13(10)12/h3-4,9,11-12,16H,2,5-8H2,1H3.
What are the key properties of 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol?
1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol has a molecular weight of 217.31 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)propan-1-ol is sourced from PubChem (CID 79746233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).