1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine

C18H28N2 — CID 61039134

IUPAC1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine
SMILESCCN1CCC(NC2CC(c3cccc(C)c3)C2)CC1
InChIInChI=1S/C18H28N2/c1-3-20-9-7-17(8-10-20)19-18-12-16(13-18)15-6-4-5-14(2)11-15/h4-6,11,16-19H,3,7-10,12-13H2,1-2H3
InChIKeyRHBWEHXOTBFJGV-UHFFFAOYSA-N
MW272.44 g/mol
LogP3.31
Rot. Bonds4

About 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine

1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine (PubChem CID 61039134) has the molecular formula C18H28N2 and a molecular weight of 272.44 g/mol. Its IUPAC name is 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine.

Molecular Properties

Compound Name1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine
PubChem CID61039134
Molecular FormulaC18H28N2
Molecular Weight272.44 g/mol
Exact Mass272.23
IUPAC Name1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine
SMILESCCN1CCC(NC2CC(c3cccc(C)c3)C2)CC1
InChIInChI=1S/C18H28N2/c1-3-20-9-7-17(8-10-20)19-18-12-16(13-18)15-6-4-5-14(2)11-15/h4-6,11,16-19H,3,7-10,12-13H2,1-2H3
InChIKeyRHBWEHXOTBFJGV-UHFFFAOYSA-N
XLogP3.31
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.44
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-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

1-ethyl-N-(3-phenylcyclobutyl)piperidin-4-amine
CID 54917521
N-[3-(3-methylphenyl)cyclobutyl]cyclopentanamine
CID 43632705
N-cyclohexyl-1-ethyl-5-(3-methylphenyl)piperidin-3-amine
CID 83999044
N-[3-(3-bromophenyl)cyclobutyl]-1-propylpiperidin-4-amine
CID 43634693
N,1-diethyl-5-(3-methylphenyl)piperidin-3-amine
CID 83990215
N-ethyl-3-(3-methylphenyl)cyclobutan-1-amine
CID 43632481
2-[3-(cyclopropylamino)-5-(3-methylphenyl)piperidin-1-yl]acetonitrile
CID 83991978
2-[[3-(3-methylphenyl)cyclobutyl]amino]cyclohexan-1-ol
CID 62358842
3-(3-methylphenyl)-N-(2-methylpropyl)cyclobutan-1-amine
CID 43632690
3-(3-methylphenyl)-N-[(3-methylphenyl)methyl]cyclobutan-1-amine
CID 43634409
(3R,4R)-1-ethyl-3-(3-methylphenyl)-4-phenylpiperidine
CID 129373468
3-(3-methylphenyl)-N-[2-(1-methylpiperidin-4-yl)ethyl]cyclobutan-1-amine
CID 104530160

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine?
The IUPAC name of 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine (CID 61039134) is 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine.
What is the SMILES notation for 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine?
The canonical SMILES for 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine is CCN1CCC(NC2CC(c3cccc(C)c3)C2)CC1.
What is the InChIKey of 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine?
The InChIKey is RHBWEHXOTBFJGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2/c1-3-20-9-7-17(8-10-20)19-18-12-16(13-18)15-6-4-5-14(2)11-15/h4-6,11,16-19H,3,7-10,12-13H2,1-2H3.
What are the key properties of 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine?
1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine has a molecular weight of 272.44 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[3-(3-methylphenyl)cyclobutyl]piperidin-4-amine is sourced from PubChem (CID 61039134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).