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

C18H30N2 — CID 43684158

IUPACN-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
SMILESCCc1ccc(C(C)NC2CC(C)N(C)CC2C)cc1
InChIInChI=1S/C18H30N2/c1-6-16-7-9-17(10-8-16)15(4)19-18-11-14(3)20(5)12-13(18)2/h7-10,13-15,18-19H,6,11-12H2,1-5H3
InChIKeyOTLXDJADPWSFKN-UHFFFAOYSA-N
MW274.45 g/mol
LogP3.63
Rot. Bonds4

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

N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine (PubChem CID 43684158) has the molecular formula C18H30N2 and a molecular weight of 274.45 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
PubChem CID43684158
Molecular FormulaC18H30N2
Molecular Weight274.45 g/mol
Exact Mass274.24
IUPAC NameN-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
SMILESCCc1ccc(C(C)NC2CC(C)N(C)CC2C)cc1
InChIInChI=1S/C18H30N2/c1-6-16-7-9-17(10-8-16)15(4)19-18-11-14(3)20(5)12-13(18)2/h7-10,13-15,18-19H,6,11-12H2,1-5H3
InChIKeyOTLXDJADPWSFKN-UHFFFAOYSA-N
XLogP3.63
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.45
LogP ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-ethylphenyl)ethyl]-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-[(1R)-1-(3-fluorophenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 81368219
1,2,5-trimethyl-N-[(1R)-1-pyridin-3-ylethyl]piperidin-4-amine
CID 81407226
N-[1-(4-chlorophenyl)propan-2-yl]-1,2,5-trimethylpiperidin-4-amine
CID 43677752
1,2,5-trimethyl-N-(1-phenylpropyl)piperidin-4-amine
CID 62305036
(2R,4R,5R)-1,2,5-trimethyl-N-propan-2-ylpiperidin-4-amine
CID 93258428
N-[1-(2-methoxyphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine
CID 43665452
N-[1-(4-ethylphenyl)ethyl]-1-methylpyrrolidin-3-amine
CID 54949870
N-[1-(4-ethylphenyl)ethyl]-2,4,4-trimethylcyclohexan-1-amine
CID 81320860
3-methyl-2-[(1,2,5-trimethylpiperidin-4-yl)amino]butan-1-ol
CID 79254544
1,2,5-trimethyl-N-(5-methylhexan-2-yl)piperidin-4-amine
CID 43665462
(2R)-2-[[(2R,4R,5S)-1,2,5-trimethylpiperidin-4-yl]amino]propan-1-ol
CID 124526611
N-[1-(4-ethylphenyl)ethyl]-2-methylthian-3-amine
CID 79957461

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine (CID 43684158) is N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine is CCc1ccc(C(C)NC2CC(C)N(C)CC2C)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
The InChIKey is OTLXDJADPWSFKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30N2/c1-6-16-7-9-17(10-8-16)15(4)19-18-11-14(3)20(5)12-13(18)2/h7-10,13-15,18-19H,6,11-12H2,1-5H3.
What are the key properties of N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine?
N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine has a molecular weight of 274.45 g/mol, XLogP of 3.63, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]-1,2,5-trimethylpiperidin-4-amine is sourced from PubChem (CID 43684158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).