6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol

C16H24FNO — CID 79835548

IUPAC6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol
SMILESCN(Cc1ccc(F)cc1)C1CCCC(C)(C)C1O
InChIInChI=1S/C16H24FNO/c1-16(2)10-4-5-14(15(16)19)18(3)11-12-6-8-13(17)9-7-12/h6-9,14-15,19H,4-5,10-11H2,1-3H3
InChIKeyWDGIQMZLXLSVLU-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.20
Rot. Bonds3

About 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol

6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol (PubChem CID 79835548) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol
PubChem CID79835548
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol
SMILESCN(Cc1ccc(F)cc1)C1CCCC(C)(C)C1O
InChIInChI=1S/C16H24FNO/c1-16(2)10-4-5-14(15(16)19)18(3)11-12-6-8-13(17)9-7-12/h6-9,14-15,19H,4-5,10-11H2,1-3H3
InChIKeyWDGIQMZLXLSVLU-UHFFFAOYSA-N
XLogP3.20
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N-[(4-fluorophenyl)methyl]-1-N-methylcyclopentane-1,2-diamine
CID 61413397
6-[cyclobutylmethyl(methyl)amino]-2,2-dimethylcyclohexan-1-ol
CID 79836659
2-[(4-fluorophenyl)methyl-methylamino]cyclohexane-1-carbonitrile
CID 61412971
6-[[benzyl(methyl)amino]methyl]-2,2-dimethylcyclohexan-1-ol
CID 79849284
N-[(4-fluorophenyl)methyl]-N-methyl-2-nitrocyclohexan-1-amine
CID 22485437
2-[(4-fluorophenyl)methyl-methylamino]cyclopropane-1-carboxylic acid
CID 117042665
2-[(3-fluorophenyl)methyl-methylamino]cyclohexan-1-ol
CID 60714854
1-[2-chloro-2-(2,2-dimethylcyclopentyl)ethyl]-4-fluorobenzene
CID 107183554
6-[cyclohexyl(methyl)amino]-2,2-dimethylcyclohexan-1-ol
CID 79834390
2-cyclopentyl-1-[(4-fluorophenyl)methyl]-1-methylguanidine
CID 62361848
(1S,2S)-1-[(4-fluorophenyl)methyl-methylamino]spiro[1,2-dihydroindene-3,4'-piperidine]-2-ol
CID 133112951
N-[(4-fluorophenyl)methyl]-N-methyl-1,2,3,4-tetrahydronaphthalen-1-amine
CID 134792918

Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol?
The IUPAC name of 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol (CID 79835548) is 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol is CN(Cc1ccc(F)cc1)C1CCCC(C)(C)C1O.
What is the InChIKey of 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol?
The InChIKey is WDGIQMZLXLSVLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-16(2)10-4-5-14(15(16)19)18(3)11-12-6-8-13(17)9-7-12/h6-9,14-15,19H,4-5,10-11H2,1-3H3.
What are the key properties of 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol?
6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol has a molecular weight of 265.37 g/mol, XLogP of 3.20, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenyl)methyl-methylamino]-2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 79835548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).