[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol

C13H18N2O — CID 115560518

IUPAC[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(N2CC3CCCC3C2)nc1
InChIInChI=1S/C13H18N2O/c16-9-10-4-5-13(14-6-10)15-7-11-2-1-3-12(11)8-15/h4-6,11-12,16H,1-3,7-9H2
InChIKeyIELBUUNMSDNGHB-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.81
Rot. Bonds2

About [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol

[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol (PubChem CID 115560518) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol
PubChem CID115560518
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol
SMILESOCc1ccc(N2CC3CCCC3C2)nc1
InChIInChI=1S/C13H18N2O/c16-9-10-4-5-13(14-6-10)15-7-11-2-1-3-12(11)8-15/h4-6,11-12,16H,1-3,7-9H2
InChIKeyIELBUUNMSDNGHB-UHFFFAOYSA-N
XLogP1.81
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol with MolForge

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Related Compounds

[6-(3,5-dimethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61257054
[6-(6,6-difluoro-3-azabicyclo[3.1.0]hexan-3-yl)-3-pyridinyl]methanol
CID 156826031
N-[[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methyl]-2-methoxyethanamine
CID 115560699
[6-(3-ethylpiperidin-1-yl)-3-pyridinyl]methanol
CID 61256877
1-(5-ethyl-2-pyridinyl)pyrrolidine-3,4-diol
CID 177167295
(6-piperazin-1-yl-3-pyridinyl)methanol
CID 23385573
[6-(4-propylpiperidin-1-yl)-3-pyridinyl]methanol
CID 62205775
[6-[4-(methoxymethyl)piperidin-1-yl]-3-pyridinyl]methanol
CID 63971176
[6-(4-ethyl-3-methylpiperazin-1-yl)-3-pyridinyl]methanol
CID 55218133
N-ethyl-N'-[(6-pyrrolidin-1-yl-3-pyridinyl)methyl]-1,3,3a,4,5,6,7,7a-octahydroisoindole-2-carboximidamide
CID 109442785
[6-(5-ethyl-2-methylpiperidin-1-yl)-3-pyridinyl]methanol
CID 112734481
4-(hydroxymethyl)-1-[5-(hydroxymethyl)-2-pyridinyl]pyrrolidin-2-one
CID 168664287

Frequently Asked Questions

What is the IUPAC name of [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol?
The IUPAC name of [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol (CID 115560518) is [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol.
What is the SMILES notation for [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol?
The canonical SMILES for [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol is OCc1ccc(N2CC3CCCC3C2)nc1.
What is the InChIKey of [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol?
The InChIKey is IELBUUNMSDNGHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c16-9-10-4-5-13(14-6-10)15-7-11-2-1-3-12(11)8-15/h4-6,11-12,16H,1-3,7-9H2.
What are the key properties of [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol?
[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol has a molecular weight of 218.30 g/mol, XLogP of 1.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-3-pyridinyl]methanol is sourced from PubChem (CID 115560518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).