3-(cyclohexen-1-yl)pyrrolidin-3-ol

C10H17NO — CID 106650910

IUPAC3-(cyclohexen-1-yl)pyrrolidin-3-ol
SMILESOC1(C2=CCCCC2)CCNC1
InChIInChI=1S/C10H17NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h4,11-12H,1-3,5-8H2
InChIKeySGJQUQLADIDERR-UHFFFAOYSA-N
MW167.25 g/mol
LogP1.21
Rot. Bonds1

About 3-(cyclohexen-1-yl)pyrrolidin-3-ol

3-(cyclohexen-1-yl)pyrrolidin-3-ol (PubChem CID 106650910) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 3-(cyclohexen-1-yl)pyrrolidin-3-ol.

Molecular Properties

Compound Name3-(cyclohexen-1-yl)pyrrolidin-3-ol
PubChem CID106650910
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name3-(cyclohexen-1-yl)pyrrolidin-3-ol
SMILESOC1(C2=CCCCC2)CCNC1
InChIInChI=1S/C10H17NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h4,11-12H,1-3,5-8H2
InChIKeySGJQUQLADIDERR-UHFFFAOYSA-N
XLogP1.21
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(1R)-1-(cyclopenten-1-yl)-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 138485613
1-(cyclopenten-1-yl)-1-[(2S)-pyrrolidin-2-yl]ethanol
CID 155141463
1-[[2-(Cyclohexen-1-yl)ethylamino]methyl]cycloheptan-1-ol
CID 60710717
1-[[2-(Cyclohexen-1-yl)ethylamino]methyl]cyclopentan-1-ol
CID 65211211
3-(2-Methylprop-1-enyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 79190226
2-[(1R,6R)-9-azabicyclo[4.2.1]non-2-en-2-yl]propan-2-ol
CID 101613765
1-[[2-(Cyclopenten-1-yl)ethylamino]methyl]cyclohexan-1-ol
CID 103843119
4-(Cycloocten-1-yl)piperidin-4-ol
CID 106650881
4-(Cyclohexen-1-yl)piperidin-4-ol
CID 106650882
4-(Cyclohepten-1-yl)piperidin-4-ol
CID 106650883
3-(Cycloocten-1-yl)-1-methylpyrrolidin-3-ol
CID 106650884
3-(Cyclohexen-1-yl)-1-methylpyrrolidin-3-ol
CID 106650885

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexen-1-yl)pyrrolidin-3-ol?
The IUPAC name of 3-(cyclohexen-1-yl)pyrrolidin-3-ol (CID 106650910) is 3-(cyclohexen-1-yl)pyrrolidin-3-ol.
What is the SMILES notation for 3-(cyclohexen-1-yl)pyrrolidin-3-ol?
The canonical SMILES for 3-(cyclohexen-1-yl)pyrrolidin-3-ol is OC1(C2=CCCCC2)CCNC1.
What is the InChIKey of 3-(cyclohexen-1-yl)pyrrolidin-3-ol?
The InChIKey is SGJQUQLADIDERR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h4,11-12H,1-3,5-8H2.
What are the key properties of 3-(cyclohexen-1-yl)pyrrolidin-3-ol?
3-(cyclohexen-1-yl)pyrrolidin-3-ol has a molecular weight of 167.25 g/mol, XLogP of 1.21, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexen-1-yl)pyrrolidin-3-ol is sourced from PubChem (CID 106650910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).