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

C16H25FN2O — CID 43730175

IUPACN-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCCOc1cc(F)ccc1NC1CC(C)N(C)CC1C
InChIInChI=1S/C16H25FN2O/c1-5-20-16-9-13(17)6-7-14(16)18-15-8-12(3)19(4)10-11(15)2/h6-7,9,11-12,15,18H,5,8,10H2,1-4H3
InChIKeyNPFZWCVQZWRQEF-UHFFFAOYSA-N
MW280.39 g/mol
LogP3.37
Rot. Bonds4

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

N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43730175) has the molecular formula C16H25FN2O and a molecular weight of 280.39 g/mol. Its IUPAC name is N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
PubChem CID43730175
Molecular FormulaC16H25FN2O
Molecular Weight280.39 g/mol
Exact Mass280.20
IUPAC NameN-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
SMILESCCOc1cc(F)ccc1NC1CC(C)N(C)CC1C
InChIInChI=1S/C16H25FN2O/c1-5-20-16-9-13(17)6-7-14(16)18-15-8-12(3)19(4)10-11(15)2/h6-7,9,11-12,15,18H,5,8,10H2,1-4H3
InChIKeyNPFZWCVQZWRQEF-UHFFFAOYSA-N
XLogP3.37
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2-ethoxy-4-methylphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 60935527
N-(4-ethoxy-3-methoxyphenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43717361
N-(2-ethoxy-4-fluorophenyl)-1-azabicyclo[2.2.2]octan-3-amine
CID 43730192
N-(3-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine
CID 43665401
N-(2-ethoxyphenyl)-1,5-dimethylpyrrolidin-3-amine
CID 81465704
2-ethoxy-N-(3-ethoxycyclobutyl)-4-fluoroaniline
CID 112568490
N-(2-ethoxy-4-fluorophenyl)-2,3-dihydro-1H-inden-2-amine
CID 43730188
2-ethoxy-4-fluoro-N-(3-phenylcyclobutyl)aniline
CID 43730168
2-ethoxy-4-fluoro-N-(2-methylsulfonylcyclopentyl)aniline
CID 65044191
N-(2-ethoxy-4-fluorophenyl)-1-ethylazepan-4-amine
CID 65074721
N-[4-bromo-2-(trifluoromethyl)phenyl]-1,2,5-trimethylpiperidin-4-amine
CID 60792541
N-(2-ethoxy-4-fluorophenyl)-1,1-dioxothian-4-amine
CID 43730186

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine (CID 43730175) is N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine is CCOc1cc(F)ccc1NC1CC(C)N(C)CC1C.
What is the InChIKey of N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is NPFZWCVQZWRQEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25FN2O/c1-5-20-16-9-13(17)6-7-14(16)18-15-8-12(3)19(4)10-11(15)2/h6-7,9,11-12,15,18H,5,8,10H2,1-4H3.
What are the key properties of N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine?
N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 280.39 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-fluorophenyl)-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43730175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).