2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine

C13H18F2N2 — CID 106528476

IUPAC2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine
SMILESNCC(c1cc(F)cc(F)c1)N1CCCCC1
InChIInChI=1S/C13H18F2N2/c14-11-6-10(7-12(15)8-11)13(9-16)17-4-2-1-3-5-17/h6-8,13H,1-5,9,16H2
InChIKeyUTHIBDIDXPCXDC-UHFFFAOYSA-N
MW240.30 g/mol
LogP2.45
Rot. Bonds3

About 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine

2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine (PubChem CID 106528476) has the molecular formula C13H18F2N2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine.

Molecular Properties

Compound Name2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine
PubChem CID106528476
Molecular FormulaC13H18F2N2
Molecular Weight240.30 g/mol
Exact Mass240.14
IUPAC Name2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine
SMILESNCC(c1cc(F)cc(F)c1)N1CCCCC1
InChIInChI=1S/C13H18F2N2/c14-11-6-10(7-12(15)8-11)13(9-16)17-4-2-1-3-5-17/h6-8,13H,1-5,9,16H2
InChIKeyUTHIBDIDXPCXDC-UHFFFAOYSA-N
XLogP2.45
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-piperidin-1-yl-2-(3,4,5-trifluorophenyl)ethanamine
CID 63051253
2-(azepan-1-yl)-2-(4-fluorophenyl)ethanamine
CID 6484142
2-(azepan-1-yl)-2-(3,5-dichlorophenyl)ethanamine
CID 60788814
2-(3,5-difluorophenyl)-2-(4-methylsulfonylpiperazin-1-yl)ethanamine
CID 106528646
3-(3,5-difluorophenyl)-3-pyrrolidin-1-ylpropanoic acid
CID 106534415
2-[3-(difluoromethyl)phenyl]-2-piperidin-1-ylethanamine
CID 115526755
(2R)-2-(2,5-difluorophenyl)-2-pyrrolidin-1-ylethanamine
CID 93285194
2-(5-fluoro-2-methylphenyl)-2-piperidin-1-ylethanamine
CID 114075463
2-(3,5-difluorophenyl)-2-(2,6-dimethylmorpholin-4-yl)ethanamine
CID 106528465
2-(azocan-1-yl)-2-(4-chloro-2-fluorophenyl)ethanamine
CID 114842840
2-(3,5-difluorophenyl)-2-[(2R,6S)-2,6-dimethylmorpholin-4-yl]ethanamine
CID 106528795
2-(4-fluoro-2-methylphenyl)-2-piperidin-1-ylethanamine
CID 62136156

Frequently Asked Questions

What is the IUPAC name of 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine?
The IUPAC name of 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine (CID 106528476) is 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine.
What is the SMILES notation for 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine?
The canonical SMILES for 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine is NCC(c1cc(F)cc(F)c1)N1CCCCC1.
What is the InChIKey of 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine?
The InChIKey is UTHIBDIDXPCXDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18F2N2/c14-11-6-10(7-12(15)8-11)13(9-16)17-4-2-1-3-5-17/h6-8,13H,1-5,9,16H2.
What are the key properties of 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine?
2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine has a molecular weight of 240.30 g/mol, XLogP of 2.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,5-difluorophenyl)-2-piperidin-1-ylethanamine is sourced from PubChem (CID 106528476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).