[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol

C8H15NO — CID 169000645

IUPAC[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol
SMILESOC[C@H]1CCC2CCCN21
InChIInChI=1S/C8H15NO/c10-6-8-4-3-7-2-1-5-9(7)8/h7-8,10H,1-6H2/t7?,8-/m1/s1
InChIKeyQDMDCGZXSSNONP-BRFYHDHCSA-N
MW141.21 g/mol
LogP0.61
Rot. Bonds1

About [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol

[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol (PubChem CID 169000645) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol
PubChem CID169000645
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol
SMILESOC[C@H]1CCC2CCCN21
InChIInChI=1S/C8H15NO/c10-6-8-4-3-7-2-1-5-9(7)8/h7-8,10H,1-6H2/t7?,8-/m1/s1
InChIKeyQDMDCGZXSSNONP-BRFYHDHCSA-N
XLogP0.61
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[(5S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]methanol
CID 11344137
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CID 105427328
[1-(azepan-4-yl)pyrrolidin-2-yl]methanol
CID 84668410
2-[(5S,8aR)-1,2,3,5,6,7,8,8a-octahydroindolizin-5-yl]ethanol
CID 130941698
1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazin-4-ylmethanol
CID 59215878
3-(2-chloroethyl)-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
CID 139644525
[1-(oxan-4-yl)piperidin-2-yl]methanol
CID 63937117
[1-(1,1-dioxothiolan-3-yl)piperidin-2-yl]methanol
CID 62021749
[(6S,8aS)-1,2,3,4,6,7,8,8a-octahydropyrrolo[1,2-a]pyrazin-6-yl]methanol
CID 131114768
[1-(3-aminocyclopentyl)azepan-2-yl]methanol
CID 116640609
2,3,4,6,7,8,9,9a-octahydro-1H-pyrido[1,2-a]pyrazin-4-ylmethanol
CID 84653848
2-(2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-4-yl)ethanol
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Frequently Asked Questions

What is the IUPAC name of [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol?
The IUPAC name of [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol (CID 169000645) is [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol.
What is the SMILES notation for [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol?
The canonical SMILES for [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol is OC[C@H]1CCC2CCCN21.
What is the InChIKey of [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol?
The InChIKey is QDMDCGZXSSNONP-BRFYHDHCSA-N. The full InChI is InChI=1S/C8H15NO/c10-6-8-4-3-7-2-1-5-9(7)8/h7-8,10H,1-6H2/t7?,8-/m1/s1.
What are the key properties of [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol?
[(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol has a molecular weight of 141.21 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-2,3,5,6,7,8-hexahydro-1H-pyrrolizin-3-yl]methanol is sourced from PubChem (CID 169000645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).