N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine

C14H20F2N2O2 — CID 154783141

IUPACN-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine
SMILESCON1CCC(Nc2ccccc2OCC(F)F)CC1
InChIInChI=1S/C14H20F2N2O2/c1-19-18-8-6-11(7-9-18)17-12-4-2-3-5-13(12)20-10-14(15)16/h2-5,11,14,17H,6-10H2,1H3
InChIKeyRMKMIDSJFXOZLO-UHFFFAOYSA-N
MW286.32 g/mol
LogP2.77
Rot. Bonds6

About N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine

N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine (PubChem CID 154783141) has the molecular formula C14H20F2N2O2 and a molecular weight of 286.32 g/mol. Its IUPAC name is N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine
PubChem CID154783141
Molecular FormulaC14H20F2N2O2
Molecular Weight286.32 g/mol
Exact Mass286.15
IUPAC NameN-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine
SMILESCON1CCC(Nc2ccccc2OCC(F)F)CC1
InChIInChI=1S/C14H20F2N2O2/c1-19-18-8-6-11(7-9-18)17-12-4-2-3-5-13(12)20-10-14(15)16/h2-5,11,14,17H,6-10H2,1H3
InChIKeyRMKMIDSJFXOZLO-UHFFFAOYSA-N
XLogP2.77
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.32
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-ethyl-N-[2-(2-methylpropoxy)phenyl]piperidin-4-amine
CID 60934851
N-cyclopentyl-2-(2-methylpropoxy)aniline
CID 54864910
N-(2-methoxyphenyl)-1-propan-2-ylpiperidin-4-amine
CID 5131485
ethyl 4-(2-ethoxyanilino)piperidine-1-carboxylate
CID 43758190
1-methyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]azepan-4-amine
CID 65070364
N-[2-(2,2-difluoroethoxy)phenyl]-3-(ethoxymethyl)pyrrolidine-1-carboxamide
CID 71849484
2-chloro-1-[4-(2-methoxyanilino)piperidin-1-yl]ethanone
CID 154803745
N-[2-(difluoromethoxy)phenyl]-1-methylpyrrolidin-3-amine
CID 62977442
N-cyclohexyl-2-propoxyaniline
CID 43682292
N-(3-methylcyclohexyl)-2-(2-methylpropoxy)aniline
CID 63453489
methyl 2-[4-(2-methoxyanilino)piperidin-1-yl]acetate
CID 71857529
N-(3,3-dimethylcyclopentyl)-2-(2-methylpropoxy)aniline
CID 80706319

Frequently Asked Questions

What is the IUPAC name of N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine?
The IUPAC name of N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine (CID 154783141) is N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine.
What is the SMILES notation for N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine?
The canonical SMILES for N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine is CON1CCC(Nc2ccccc2OCC(F)F)CC1.
What is the InChIKey of N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine?
The InChIKey is RMKMIDSJFXOZLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O2/c1-19-18-8-6-11(7-9-18)17-12-4-2-3-5-13(12)20-10-14(15)16/h2-5,11,14,17H,6-10H2,1H3.
What are the key properties of N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine?
N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine has a molecular weight of 286.32 g/mol, XLogP of 2.77, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,2-difluoroethoxy)phenyl]-1-methoxypiperidin-4-amine is sourced from PubChem (CID 154783141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).