N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine

C16H25FN2 — CID 168961754

IUPACN,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
SMILESCCN(CC)C1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H25FN2/c1-3-19(4-2)16-9-11-18(12-10-16)13-14-5-7-15(17)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3
InChIKeyJJZVSPRACVXTRT-UHFFFAOYSA-N
MW264.39 g/mol
LogP3.13
Rot. Bonds5

About N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine

N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine (PubChem CID 168961754) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine.

Molecular Properties

Compound NameN,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
PubChem CID168961754
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC NameN,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine
SMILESCCN(CC)C1CCN(Cc2ccc(F)cc2)CC1
InChIInChI=1S/C16H25FN2/c1-3-19(4-2)16-9-11-18(12-10-16)13-14-5-7-15(17)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3
InChIKeyJJZVSPRACVXTRT-UHFFFAOYSA-N
XLogP3.13
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(4-tert-butylphenyl)methyl]-N,N-diethylpiperidin-4-amine
CID 118683629
1,4,7,10-tetrakis[(4-fluorophenyl)methyl]-1,4,7,10-tetrazacyclododecane
CID 102293981
N-benzyl-1-[(4-fluorophenyl)methyl]-N-methylpiperidin-4-amine
CID 754317
1-[(4-ethylphenyl)methyl]-4-[(4-fluorophenyl)methyl]piperazine
CID 881940
1-[[4-(aminomethyl)phenyl]methyl]-N,N-diethylpyrrolidin-3-amine
CID 63166878
4-cyclohexyl-1-[(4-fluorophenyl)methyl]piperidine
CID 174420466
4-methyl-1-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]piperidine
CID 53443850
1-[(4-fluorophenyl)methyl]pyrrolidine
CID 10631195
N-(4-ethylphenyl)-4-fluoro-N-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]benzamide
CID 46052023
2-[[1-[(3-chloro-5-fluorophenyl)methyl]piperidin-4-yl]-ethylamino]acetic acid
CID 122043247
1-[(4-fluorophenyl)methyl]piperidine-4-carboxylic acid
CID 4641825
1-[(4-fluorophenyl)methyl]-4-piperidin-4-ylpiperidine;dihydrochloride
CID 167312057

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The IUPAC name of N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine (CID 168961754) is N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine.
What is the SMILES notation for N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The canonical SMILES for N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine is CCN(CC)C1CCN(Cc2ccc(F)cc2)CC1.
What is the InChIKey of N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
The InChIKey is JJZVSPRACVXTRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-3-19(4-2)16-9-11-18(12-10-16)13-14-5-7-15(17)8-6-14/h5-8,16H,3-4,9-13H2,1-2H3.
What are the key properties of N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine?
N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine has a molecular weight of 264.39 g/mol, XLogP of 3.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1-[(4-fluorophenyl)methyl]piperidin-4-amine is sourced from PubChem (CID 168961754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).