[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol

C8H16N2O — CID 129365913

IUPAC[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol
SMILESOC[C@]12CCCN1CCNC2
InChIInChI=1S/C8H16N2O/c11-7-8-2-1-4-10(8)5-3-9-6-8/h9,11H,1-7H2/t8-/m1/s1
InChIKeyVHNVKVILFAFJMN-MRVPVSSYSA-N
MW156.23 g/mol
LogP-0.58
Rot. Bonds1

About [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol

[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol (PubChem CID 129365913) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol.

Molecular Properties

Compound Name[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol
PubChem CID129365913
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol
SMILESOC[C@]12CCCN1CCNC2
InChIInChI=1S/C8H16N2O/c11-7-8-2-1-4-10(8)5-3-9-6-8/h9,11H,1-7H2/t8-/m1/s1
InChIKeyVHNVKVILFAFJMN-MRVPVSSYSA-N
XLogP-0.58
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol with MolForge

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Related Compounds

2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-ylmethanol
CID 45122045
1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethanol;methane
CID 164534379
1,2,3,5,6,7-hexahydropyrrolizin-8-ylmethanol;hydrochloride
CID 12691221
[1-(azepan-1-yl)cyclopentyl]methanol
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[3-(1,4-diazepan-1-yl)-1,1-dioxothiolan-3-yl]methanol
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[3-(1,4-diazepan-1-yl)oxolan-3-yl]methanol
CID 63333605
2-(1-piperazin-1-ylcyclohexyl)acetic acid
CID 115035729
(4-piperazin-1-ylthian-4-yl)methanol
CID 61337983
(1,1-dioxo-3-piperazin-1-ylthiolan-3-yl)methanol
CID 63165904
[1-(1,4-diazepan-1-yl)-3-ethylcyclopentyl]methanol
CID 64513850
[1-(1,4-diazepan-1-yl)-3-methoxycyclobutyl]methanol
CID 106823992
[2-(1,4-diazepan-1-yl)-1,3-dihydroinden-2-yl]methanol
CID 61048443

Frequently Asked Questions

What is the IUPAC name of [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol?
The IUPAC name of [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol (CID 129365913) is [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol.
What is the SMILES notation for [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol?
The canonical SMILES for [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol is OC[C@]12CCCN1CCNC2.
What is the InChIKey of [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol?
The InChIKey is VHNVKVILFAFJMN-MRVPVSSYSA-N. The full InChI is InChI=1S/C8H16N2O/c11-7-8-2-1-4-10(8)5-3-9-6-8/h9,11H,1-7H2/t8-/m1/s1.
What are the key properties of [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol?
[(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol has a molecular weight of 156.23 g/mol, XLogP of -0.58, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(8aR)-2,3,4,6,7,8-hexahydro-1H-pyrrolo[1,2-a]pyrazin-8a-yl]methanol is sourced from PubChem (CID 129365913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).