1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol

C16H24FNO — CID 107128539

IUPAC1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol
SMILESCc1ccc(C(O)C(C)(C)N2CCCCC2)cc1F
InChIInChI=1S/C16H24FNO/c1-12-7-8-13(11-14(12)17)15(19)16(2,3)18-9-5-4-6-10-18/h7-8,11,15,19H,4-6,9-10H2,1-3H3
InChIKeyOYUDIEGCCUSFNM-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.43
Rot. Bonds3

About 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol

1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol (PubChem CID 107128539) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol.

Molecular Properties

Compound Name1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol
PubChem CID107128539
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol
SMILESCc1ccc(C(O)C(C)(C)N2CCCCC2)cc1F
InChIInChI=1S/C16H24FNO/c1-12-7-8-13(11-14(12)17)15(19)16(2,3)18-9-5-4-6-10-18/h7-8,11,15,19H,4-6,9-10H2,1-3H3
InChIKeyOYUDIEGCCUSFNM-UHFFFAOYSA-N
XLogP3.43
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 ≤ 53.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-amine
CID 107128890
1-(4-fluorophenyl)-2-methyl-2-pyrrolidin-1-ylpropan-1-ol
CID 79056202
2-(azepan-1-yl)-1-(3,4-dichlorophenyl)-2-methylpropan-1-ol
CID 79051073
2-(azepan-1-yl)-2-methyl-1-(5-methylthiophen-2-yl)propan-1-ol
CID 79052267
2-methyl-1-(5-methylthiophen-3-yl)-2-piperidin-1-ylpropan-1-ol
CID 79044854
2-(azepan-1-yl)-1-(3,4-dimethylphenyl)-2-methylpropan-1-amine
CID 79051219
2-ethoxy-1-(3-fluoro-4-methylphenyl)-2-methylpropan-1-ol
CID 107128616
(1S)-1-(3-fluoro-4-methylphenyl)-3-pyrrolidin-1-ylpropan-1-ol
CID 70250173
2-methyl-2-pyrrolidin-1-yl-1-quinolin-6-ylpropan-1-ol
CID 81219930
2-(azepan-1-yl)-2-methyl-1-pyrimidin-5-ylpropan-1-ol
CID 79051209
2-methyl-2-piperidin-1-yl-1-pyrimidin-5-ylpropan-1-ol
CID 79045835
2-methyl-1-(5-methyl-3-pyridinyl)-2-pyrrolidin-1-ylpropan-1-ol
CID 115374168

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol?
The IUPAC name of 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol (CID 107128539) is 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol.
What is the SMILES notation for 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol?
The canonical SMILES for 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol is Cc1ccc(C(O)C(C)(C)N2CCCCC2)cc1F.
What is the InChIKey of 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol?
The InChIKey is OYUDIEGCCUSFNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-12-7-8-13(11-14(12)17)15(19)16(2,3)18-9-5-4-6-10-18/h7-8,11,15,19H,4-6,9-10H2,1-3H3.
What are the key properties of 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol?
1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol has a molecular weight of 265.37 g/mol, XLogP of 3.43, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoro-4-methylphenyl)-2-methyl-2-piperidin-1-ylpropan-1-ol is sourced from PubChem (CID 107128539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).