3-cyclohexylpyrrolidin-3-ol

C10H19NO — CID 3051562

IUPAC3-cyclohexylpyrrolidin-3-ol
SMILESOC1(C2CCCCC2)CCNC1
InChIInChI=1S/C10H19NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h9,11-12H,1-8H2
InChIKeyRLWFGBSSLZGGIE-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.29
Rot. Bonds1

About 3-cyclohexylpyrrolidin-3-ol

3-cyclohexylpyrrolidin-3-ol (PubChem CID 3051562) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3-cyclohexylpyrrolidin-3-ol.

Molecular Properties

Compound Name3-cyclohexylpyrrolidin-3-ol
PubChem CID3051562
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3-cyclohexylpyrrolidin-3-ol
SMILESOC1(C2CCCCC2)CCNC1
InChIInChI=1S/C10H19NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h9,11-12H,1-8H2
InChIKeyRLWFGBSSLZGGIE-UHFFFAOYSA-N
XLogP1.29
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-cyclohexylpyrrolidin-3-ol?
The IUPAC name of 3-cyclohexylpyrrolidin-3-ol (CID 3051562) is 3-cyclohexylpyrrolidin-3-ol.
What is the SMILES notation for 3-cyclohexylpyrrolidin-3-ol?
The canonical SMILES for 3-cyclohexylpyrrolidin-3-ol is OC1(C2CCCCC2)CCNC1.
What is the InChIKey of 3-cyclohexylpyrrolidin-3-ol?
The InChIKey is RLWFGBSSLZGGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c12-10(6-7-11-8-10)9-4-2-1-3-5-9/h9,11-12H,1-8H2.
What are the key properties of 3-cyclohexylpyrrolidin-3-ol?
3-cyclohexylpyrrolidin-3-ol has a molecular weight of 169.27 g/mol, XLogP of 1.29, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclohexylpyrrolidin-3-ol is sourced from PubChem (CID 3051562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).