N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine

C14H21FN2 — CID 43665401

IUPACN-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1Nc1cccc(F)c1
InChIInChI=1S/C14H21FN2/c1-10-9-17(3)11(2)7-14(10)16-13-6-4-5-12(15)8-13/h4-6,8,10-11,14,16H,7,9H2,1-3H3
InChIKeyRBNMKVOWOWUEKG-UHFFFAOYSA-N
MW236.33 g/mol
LogP2.97
Rot. Bonds2

About N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine

N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43665401) has the molecular formula C14H21FN2 and a molecular weight of 236.33 g/mol. Its IUPAC name is N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID43665401
Molecular FormulaC14H21FN2
Molecular Weight236.33 g/mol
Exact Mass236.17
IUPAC NameN-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCC1CN(C)C(C)CC1Nc1cccc(F)c1
InChIInChI=1S/C14H21FN2/c1-10-9-17(3)11(2)7-14(10)16-13-6-4-5-12(15)8-13/h4-6,8,10-11,14,16H,7,9H2,1-3H3
InChIKeyRBNMKVOWOWUEKG-UHFFFAOYSA-N
XLogP2.97
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.33
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-[(1,2,5-trimethylpiperidin-4-yl)amino]phenyl]methanol
CID 43715216
N-(4-bromo-3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 65435866
(2S,4R,5S)-N-[3-[(1R)-1-methoxyethyl]phenyl]-1,2,5-trimethylpiperidin-4-amine
CID 124776821
N-[(1R)-1-(3-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 81368219
N-(2-fluoro-3-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 113354253
N-[4-(difluoromethoxy)-3-fluorophenyl]-1,2,5-trimethylpiperidin-4-amine
CID 60942486
N-(4-chlorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665402
N-(4-tert-butylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665344
N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43730175
N-(4-chloro-3-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 107270537
N-(3-chloro-4-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665336
N-(3-bromo-4-nitrophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 82865025

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine (CID 43665401) is N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine is CC1CN(C)C(C)CC1Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is RBNMKVOWOWUEKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21FN2/c1-10-9-17(3)11(2)7-14(10)16-13-6-4-5-12(15)8-13/h4-6,8,10-11,14,16H,7,9H2,1-3H3.
What are the key properties of N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 236.33 g/mol, XLogP of 2.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43665401), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).