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

C13H18N2O — CID 79740627

IUPAC3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol
SMILESCN1CCC(O)(C2CCc3cccnc32)C1
InChIInChI=1S/C13H18N2O/c1-15-8-6-13(16,9-15)11-5-4-10-3-2-7-14-12(10)11/h2-3,7,11,16H,4-6,8-9H2,1H3
InChIKeyIQDBKBFZSDRGSR-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.18
Rot. Bonds1

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

3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol (PubChem CID 79740627) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol
PubChem CID79740627
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol
SMILESCN1CCC(O)(C2CCc3cccnc32)C1
InChIInChI=1S/C13H18N2O/c1-15-8-6-13(16,9-15)11-5-4-10-3-2-7-14-12(10)11/h2-3,7,11,16H,4-6,8-9H2,1H3
InChIKeyIQDBKBFZSDRGSR-UHFFFAOYSA-N
XLogP1.18
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-propylpiperidin-4-ol
CID 79739783
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)cycloheptan-1-ol
CID 79739276
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-3-methylcyclohexan-1-ol
CID 79739872
4-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)azepan-4-ol
CID 103982975
1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-ol
CID 79739365
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4,4-dimethylcyclohexan-1-amine
CID 79745639
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-2-ethylcyclohexan-1-ol
CID 79746150
4-propan-2-yl-1-(5,6,7,8-tetrahydroquinolin-8-yl)cycloheptan-1-ol
CID 79723752
7-(2-methylpyrrolidin-2-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine
CID 79748241
1-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-4-propan-2-ylcyclohexan-1-amine
CID 79745794
2-methoxy-1-(5,6,7,8-tetrahydroquinolin-8-yl)cyclohexan-1-ol
CID 106873740
(8S)-8-(3,3-difluoropyrrolidin-1-yl)-5,6,7,8-tetrahydroquinoline
CID 142548909

Frequently Asked Questions

What is the IUPAC name of 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol?
The IUPAC name of 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol (CID 79740627) is 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol.
What is the SMILES notation for 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol?
The canonical SMILES for 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol is CN1CCC(O)(C2CCc3cccnc32)C1.
What is the InChIKey of 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol?
The InChIKey is IQDBKBFZSDRGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-15-8-6-13(16,9-15)11-5-4-10-3-2-7-14-12(10)11/h2-3,7,11,16H,4-6,8-9H2,1H3.
What are the key properties of 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol?
3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol has a molecular weight of 218.30 g/mol, XLogP of 1.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6,7-dihydro-5H-cyclopenta[b]pyridin-7-yl)-1-methylpyrrolidin-3-ol is sourced from PubChem (CID 79740627), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).