1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol

C14H19F2NO2 — CID 47704692

IUPAC1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol
SMILESCC(c1ccc(OC(F)F)cc1)N1CCCC(O)C1
InChIInChI=1S/C14H19F2NO2/c1-10(17-8-2-3-12(18)9-17)11-4-6-13(7-5-11)19-14(15)16/h4-7,10,12,14,18H,2-3,8-9H2,1H3
InChIKeyRNECHYPYNOVXQD-UHFFFAOYSA-N
MW271.31 g/mol
LogP2.81
Rot. Bonds4

About 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol

1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol (PubChem CID 47704692) has the molecular formula C14H19F2NO2 and a molecular weight of 271.31 g/mol. Its IUPAC name is 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol
PubChem CID47704692
Molecular FormulaC14H19F2NO2
Molecular Weight271.31 g/mol
Exact Mass271.14
IUPAC Name1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol
SMILESCC(c1ccc(OC(F)F)cc1)N1CCCC(O)C1
InChIInChI=1S/C14H19F2NO2/c1-10(17-8-2-3-12(18)9-17)11-4-6-13(7-5-11)19-14(15)16/h4-7,10,12,14,18H,2-3,8-9H2,1H3
InChIKeyRNECHYPYNOVXQD-UHFFFAOYSA-N
XLogP2.81
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.31
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-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-[1-[4-(difluoromethoxy)phenyl]ethyl]-N-methylpiperidin-3-amine;hydrochloride
CID 119919002
[1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-4-yl]methanol
CID 47524579
(3S)-1-[1-(4-fluorophenyl)ethyl]pyrrolidin-3-ol
CID 126787911
2-[4-[1-[4-(difluoromethoxy)phenyl]ethyl]piperazin-1-yl]ethanol
CID 47520543
1-[(1S)-1-phenylethyl]pyrrolidin-3-ol
CID 69382807
2-[4-(difluoromethoxy)phenyl]-1-(3-hydroxypiperidin-1-yl)ethanone
CID 43393280
N-[[4-(difluoromethoxy)phenyl]methyl]-2-(3-hydroxypiperidin-1-yl)-N-methylacetamide
CID 78787306
1-[2-amino-1-(4-fluorophenyl)propyl]piperidin-3-ol
CID 55016863
(3S)-1-[1-(furan-2-yl)ethyl]piperidin-3-ol
CID 71633408
1-[1-(2,5-difluorophenyl)ethyl]piperidin-3-ol
CID 110900453
fluoromethane;1-propan-2-ylpiperidin-3-ol
CID 176976990
[(3S)-3-hydroxypiperidin-1-yl]-(4-propan-2-yloxyphenyl)methanone
CID 39950124

Frequently Asked Questions

What is the IUPAC name of 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol?
The IUPAC name of 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol (CID 47704692) is 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol.
What is the SMILES notation for 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol?
The canonical SMILES for 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol is CC(c1ccc(OC(F)F)cc1)N1CCCC(O)C1.
What is the InChIKey of 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol?
The InChIKey is RNECHYPYNOVXQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19F2NO2/c1-10(17-8-2-3-12(18)9-17)11-4-6-13(7-5-11)19-14(15)16/h4-7,10,12,14,18H,2-3,8-9H2,1H3.
What are the key properties of 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol?
1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol has a molecular weight of 271.31 g/mol, XLogP of 2.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[4-(difluoromethoxy)phenyl]ethyl]piperidin-3-ol is sourced from PubChem (CID 47704692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).