N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine

C16H25FN2 — CID 43665339

IUPACN-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCCc1ccc(F)cc1
InChIInChI=1S/C16H25FN2/c1-12-11-19(3)13(2)10-16(12)18-9-8-14-4-6-15(17)7-5-14/h4-7,12-13,16,18H,8-11H2,1-3H3
InChIKeySZRHRTPCNJLWLV-UHFFFAOYSA-N
MW264.39 g/mol
LogP2.69
Rot. Bonds4

About N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine

N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43665339) has the molecular formula C16H25FN2 and a molecular weight of 264.39 g/mol. Its IUPAC name is N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
PubChem CID43665339
Molecular FormulaC16H25FN2
Molecular Weight264.39 g/mol
Exact Mass264.20
IUPAC NameN-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1NCCc1ccc(F)cc1
InChIInChI=1S/C16H25FN2/c1-12-11-19(3)13(2)10-16(12)18-9-8-14-4-6-15(17)7-5-14/h4-7,12-13,16,18H,8-11H2,1-3H3
InChIKeySZRHRTPCNJLWLV-UHFFFAOYSA-N
XLogP2.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 52.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,4S,5R)-N-[2-(2-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 93258463
(2R,4R,5S)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 6544101
(2R,4R,5R)-N-[2-(1,3-benzodioxol-5-yl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 97321684
2-[[(2R,4S,5R)-1,2,5-trimethylpiperidin-4-yl]amino]ethanol
CID 93258534
1,2,5-trimethyl-N-[2-(1-methylimidazol-2-yl)ethyl]piperidin-4-amine
CID 61212215
1-cyclopropyl-N-[2-(4-fluorophenyl)ethyl]-5-methylpyrrolidin-3-amine
CID 115704320
N'-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 60890113
N-[2-(4-fluorophenyl)ethyl]-2-methyloxolan-3-amine
CID 115335502
N',N'-dimethyl-N-(1,2,5-trimethylpiperidin-4-yl)propane-1,3-diamine
CID 5149120
1,2,5-trimethyl-N-(2-piperidin-1-ylethyl)piperidin-4-amine
CID 54967617
1,2,5-trimethyl-N-[2-(4-methylpiperazin-1-yl)ethyl]piperidin-4-amine
CID 54860823
1,2,5-trimethyl-N-(1H-pyrazol-4-ylmethyl)piperidin-4-amine
CID 61000035

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine (CID 43665339) is N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine is CC1CN(C)C(C)CC1NCCc1ccc(F)cc1.
What is the InChIKey of N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is SZRHRTPCNJLWLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2/c1-12-11-19(3)13(2)10-16(12)18-9-8-14-4-6-15(17)7-5-14/h4-7,12-13,16,18H,8-11H2,1-3H3.
What are the key properties of N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 264.39 g/mol, XLogP of 2.69, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43665339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).