10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol

C14H23F2NO — CID 165496828

IUPAC10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol
SMILESOC1CCC2(CCCC2)C(N2CCC(F)(F)C2)C1
InChIInChI=1S/C14H23F2NO/c15-14(16)7-8-17(10-14)12-9-11(18)3-6-13(12)4-1-2-5-13/h11-12,18H,1-10H2
InChIKeyQQCPLMSPRYVDJL-UHFFFAOYSA-N
MW259.34 g/mol
LogP2.80
Rot. Bonds1

About 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol

10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol (PubChem CID 165496828) has the molecular formula C14H23F2NO and a molecular weight of 259.34 g/mol. Its IUPAC name is 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol.

Molecular Properties

Compound Name10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol
PubChem CID165496828
Molecular FormulaC14H23F2NO
Molecular Weight259.34 g/mol
Exact Mass259.17
IUPAC Name10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol
SMILESOC1CCC2(CCCC2)C(N2CCC(F)(F)C2)C1
InChIInChI=1S/C14H23F2NO/c15-14(16)7-8-17(10-14)12-9-11(18)3-6-13(12)4-1-2-5-13/h11-12,18H,1-10H2
InChIKeyQQCPLMSPRYVDJL-UHFFFAOYSA-N
XLogP2.80
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.34
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[Cyclopentyl(methyl)amino]-4-(trifluoromethyl)cyclohexan-1-ol
CID 165490691
6-[(2,2-Difluoroethyl)(ethyl)amino]spiro[4.5]decan-8-ol
CID 165490978
6-[3-(Fluoromethyl)pyrrolidin-1-yl]spiro[4.5]decan-8-ol
CID 165490982
6-(3,3-Difluoropiperidin-1-yl)spiro[4.5]decan-8-ol
CID 165490983
6-(3-Fluoropiperidin-1-yl)spiro[4.5]decan-8-ol
CID 165490984
6-[3-(Difluoromethyl)pyrrolidin-1-yl]spiro[4.5]decan-8-ol
CID 165491363
6-[(3-Fluoropropyl)(methyl)amino]spiro[4.5]decan-8-ol
CID 165491365
3-[(2,2-Difluoroethyl)(ethyl)amino]-4,4-dimethylcyclohexan-1-ol
CID 165491484
3-[Methyl(2,2,2-trifluoroethyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491558
3-[(2,2-Difluoroethyl)(propyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491566
3-[(2,2-Difluoropropyl)(methyl)amino]-4-(2-methylbutan-2-yl)cyclohexan-1-ol
CID 165491570
4-Tert-butyl-3-[(2,2-difluoroethyl)(methyl)amino]cyclohexan-1-ol
CID 165491978

Frequently Asked Questions

What is the IUPAC name of 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol?
The IUPAC name of 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol (CID 165496828) is 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol.
What is the SMILES notation for 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol?
The canonical SMILES for 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol is OC1CCC2(CCCC2)C(N2CCC(F)(F)C2)C1.
What is the InChIKey of 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol?
The InChIKey is QQCPLMSPRYVDJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23F2NO/c15-14(16)7-8-17(10-14)12-9-11(18)3-6-13(12)4-1-2-5-13/h11-12,18H,1-10H2.
What are the key properties of 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol?
10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol has a molecular weight of 259.34 g/mol, XLogP of 2.80, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-(3,3-difluoropyrrolidin-1-yl)spiro[4.5]decan-8-ol is sourced from PubChem (CID 165496828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).