5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol

C9H12N2O — CID 83905435

IUPAC5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol
SMILESNCC1(O)CCc2ncccc21
InChIInChI=1S/C9H12N2O/c10-6-9(12)4-3-8-7(9)2-1-5-11-8/h1-2,5,12H,3-4,6,10H2
InChIKeyORYNAZVFHUKGLO-UHFFFAOYSA-N
MW164.21 g/mol
LogP0.17
Rot. Bonds1

About 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol

5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol (PubChem CID 83905435) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol.

Molecular Properties

Compound Name5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol
PubChem CID83905435
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol
SMILESNCC1(O)CCc2ncccc21
InChIInChI=1S/C9H12N2O/c10-6-9(12)4-3-8-7(9)2-1-5-11-8/h1-2,5,12H,3-4,6,10H2
InChIKeyORYNAZVFHUKGLO-UHFFFAOYSA-N
XLogP0.17
TPSA59.14 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 50.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol?
The IUPAC name of 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol (CID 83905435) is 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol.
What is the SMILES notation for 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol?
The canonical SMILES for 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol is NCC1(O)CCc2ncccc21.
What is the InChIKey of 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol?
The InChIKey is ORYNAZVFHUKGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c10-6-9(12)4-3-8-7(9)2-1-5-11-8/h1-2,5,12H,3-4,6,10H2.
What are the key properties of 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol?
5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol has a molecular weight of 164.21 g/mol, XLogP of 0.17, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-6,7-dihydrocyclopenta[b]pyridin-5-ol is sourced from PubChem (CID 83905435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).