3-pyrrolidin-3-ylcyclohexan-1-ol

C10H19NO — CID 84731820

IUPAC3-pyrrolidin-3-ylcyclohexan-1-ol
SMILESOC1CCCC(C2CCNC2)C1
InChIInChI=1S/C10H19NO/c12-10-3-1-2-8(6-10)9-4-5-11-7-9/h8-12H,1-7H2
InChIKeyBTGIVFFZZWBENR-UHFFFAOYSA-N
MW169.27 g/mol
LogP1.15
Rot. Bonds1

About 3-pyrrolidin-3-ylcyclohexan-1-ol

3-pyrrolidin-3-ylcyclohexan-1-ol (PubChem CID 84731820) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is 3-pyrrolidin-3-ylcyclohexan-1-ol.

Molecular Properties

Compound Name3-pyrrolidin-3-ylcyclohexan-1-ol
PubChem CID84731820
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name3-pyrrolidin-3-ylcyclohexan-1-ol
SMILESOC1CCCC(C2CCNC2)C1
InChIInChI=1S/C10H19NO/c12-10-3-1-2-8(6-10)9-4-5-11-7-9/h8-12H,1-7H2
InChIKeyBTGIVFFZZWBENR-UHFFFAOYSA-N
XLogP1.15
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 ≤ 51.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3,4,4a,5,6,7,7a-octahydro-1H-cyclopenta[c]pyridine;hydrochloride
CID 131638052
3-(3-hydroxycyclohexyl)cycloheptan-1-ol
CID 129132382
trans-(1R,3R)-3-cyclopentylcyclohexan-1-ol
CID 66963449
1,2,3,4,4a,5,6,7,8,8a-decahydro-2,6-naphthyridine
CID 5255831
(4aR,9aR)-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[c]pyridine
CID 92720083
bis(1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline);silane
CID 158507793
(4aS,10aR)-1,2,3,4,4a,5,6,7,8,9,10,10a-dodecahydrocycloocta[c]pyridine
CID 164752917
(3aS,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-isoindol-5-ol
CID 74889665
1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;ethane
CID 142260650
(3aS,5S,7aS)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-ol
CID 13056507
1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline-5,7-diol
CID 117046494
(8aS)-1,2,3,4,4a,5,6,7,8,8a-decahydroisoquinoline;formic acid
CID 143297207

Frequently Asked Questions

What is the IUPAC name of 3-pyrrolidin-3-ylcyclohexan-1-ol?
The IUPAC name of 3-pyrrolidin-3-ylcyclohexan-1-ol (CID 84731820) is 3-pyrrolidin-3-ylcyclohexan-1-ol.
What is the SMILES notation for 3-pyrrolidin-3-ylcyclohexan-1-ol?
The canonical SMILES for 3-pyrrolidin-3-ylcyclohexan-1-ol is OC1CCCC(C2CCNC2)C1.
What is the InChIKey of 3-pyrrolidin-3-ylcyclohexan-1-ol?
The InChIKey is BTGIVFFZZWBENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO/c12-10-3-1-2-8(6-10)9-4-5-11-7-9/h8-12H,1-7H2.
What are the key properties of 3-pyrrolidin-3-ylcyclohexan-1-ol?
3-pyrrolidin-3-ylcyclohexan-1-ol has a molecular weight of 169.27 g/mol, XLogP of 1.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrrolidin-3-ylcyclohexan-1-ol is sourced from PubChem (CID 84731820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).