3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol

C16H24FNO — CID 83983299

IUPAC3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol
SMILESCC(CO)CC1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H24FNO/c1-13(12-19)10-14-6-8-18(9-7-14)11-15-2-4-16(17)5-3-15/h2-5,13-14,19H,6-12H2,1H3
InChIKeyLTQOCQCRBSREOV-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.06
Rot. Bonds5

About 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol

3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol (PubChem CID 83983299) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol
PubChem CID83983299
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol
SMILESCC(CO)CC1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H24FNO/c1-13(12-19)10-14-6-8-18(9-7-14)11-15-2-4-16(17)5-3-15/h2-5,13-14,19H,6-12H2,1H3
InChIKeyLTQOCQCRBSREOV-UHFFFAOYSA-N
XLogP3.06
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-amine
CID 83983298
N-[[1-[(4-fluorophenyl)methyl]piperidin-4-yl]methyl]propan-2-amine
CID 62593449
1-[1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]propan-2-amine
CID 83986159
methyl 2-amino-3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]propanoate
CID 83983286
3-amino-2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]propan-1-ol
CID 83977158
3-[1-[(4-chlorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-amine
CID 83983238
1-[1-[(4-fluorophenyl)methyl]pyrrolidin-3-yl]-N-methylpropan-2-amine
CID 83986174
3-[1-[(4-bromophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-amine
CID 83983268
methyl 2-amino-2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetate
CID 83983287
3-(1-ethylpiperidin-4-yl)-2-methylpropan-1-ol
CID 83983052
methyl 2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetate
CID 17221672
1,4,7,10-tetrakis[(4-fluorophenyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102293981

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol?
The IUPAC name of 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol (CID 83983299) is 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol.
What is the SMILES notation for 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol?
The canonical SMILES for 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol is CC(CO)CC1CCN(Cc2ccc(F)cc2)CC1.
What is the InChIKey of 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol?
The InChIKey is LTQOCQCRBSREOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-13(12-19)10-14-6-8-18(9-7-14)11-15-2-4-16(17)5-3-15/h2-5,13-14,19H,6-12H2,1H3.
What are the key properties of 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol?
3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol has a molecular weight of 265.37 g/mol, XLogP of 3.06, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]-2-methylpropan-1-ol is sourced from PubChem (CID 83983299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).