1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol

C13H18FNO — CID 117025105

IUPAC1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol
SMILESCC1(C)CCN(c2ccccc2F)CC1O
InChIInChI=1S/C13H18FNO/c1-13(2)7-8-15(9-12(13)16)11-6-4-3-5-10(11)14/h3-6,12,16H,7-9H2,1-2H3
InChIKeyLHNRPUFPNWSQJD-UHFFFAOYSA-N
MW223.29 g/mol
LogP2.42
Rot. Bonds1

About 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol

1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol (PubChem CID 117025105) has the molecular formula C13H18FNO and a molecular weight of 223.29 g/mol. Its IUPAC name is 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol.

Molecular Properties

Compound Name1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol
PubChem CID117025105
Molecular FormulaC13H18FNO
Molecular Weight223.29 g/mol
Exact Mass223.14
IUPAC Name1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol
SMILESCC1(C)CCN(c2ccccc2F)CC1O
InChIInChI=1S/C13H18FNO/c1-13(2)7-8-15(9-12(13)16)11-6-4-3-5-10(11)14/h3-6,12,16H,7-9H2,1-2H3
InChIKeyLHNRPUFPNWSQJD-UHFFFAOYSA-N
XLogP2.42
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.29
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-chlorophenyl)-4,4-dimethylpiperidin-3-ol
CID 117025109
1-(2-fluorophenyl)-3-methylazetidin-3-ol
CID 173302434
[4,4-dimethyl-1-(2-methylphenyl)piperidin-3-yl]methanol
CID 117025837
8-(2-fluorophenyl)-1,4-dioxa-8-azaspiro[4.5]decane
CID 20610156
4-amino-1-(2-fluorophenyl)piperidine-4-carboxylic acid
CID 117011781
[1-(2-fluorophenyl)-3,3-dimethylpiperidin-4-yl]methanamine
CID 117024876
2-[[1-(2-fluorophenyl)pyrrolidin-3-yl]-methylamino]ethanol
CID 117004505
N-[[1-(2-fluorophenyl)pyrrolidin-3-yl]methyl]ethanamine
CID 54792763
N,4,4-trimethyl-1-(2-methylphenyl)piperidin-3-amine
CID 117025339
3-ethyl-1-(2-fluorophenyl)piperazine
CID 64924612
3-(difluoromethyl)-1-(2-fluorophenyl)pyrrolidin-3-amine
CID 115037625
3-(2-fluorophenyl)-6-methyl-3,6-diazabicyclo[3.1.1]heptane
CID 84779141

Frequently Asked Questions

What is the IUPAC name of 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol?
The IUPAC name of 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol (CID 117025105) is 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol.
What is the SMILES notation for 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol?
The canonical SMILES for 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol is CC1(C)CCN(c2ccccc2F)CC1O.
What is the InChIKey of 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol?
The InChIKey is LHNRPUFPNWSQJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FNO/c1-13(2)7-8-15(9-12(13)16)11-6-4-3-5-10(11)14/h3-6,12,16H,7-9H2,1-2H3.
What are the key properties of 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol?
1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol has a molecular weight of 223.29 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-fluorophenyl)-4,4-dimethylpiperidin-3-ol is sourced from PubChem (CID 117025105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).