2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine

C15H20FN — CID 116507146

IUPAC2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine
SMILESNCC(F)(c1ccc(C2CCC2)cc1)C1CC1
InChIInChI=1S/C15H20FN/c16-15(10-17,14-8-9-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-7,11,14H,1-3,8-10,17H2
InChIKeyKYQWEHWLXZXLKT-UHFFFAOYSA-N
MW233.33 g/mol
LogP3.49
Rot. Bonds4

About 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine

2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine (PubChem CID 116507146) has the molecular formula C15H20FN and a molecular weight of 233.33 g/mol. Its IUPAC name is 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine.

Molecular Properties

Compound Name2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine
PubChem CID116507146
Molecular FormulaC15H20FN
Molecular Weight233.33 g/mol
Exact Mass233.16
IUPAC Name2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine
SMILESNCC(F)(c1ccc(C2CCC2)cc1)C1CC1
InChIInChI=1S/C15H20FN/c16-15(10-17,14-8-9-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-7,11,14H,1-3,8-10,17H2
InChIKeyKYQWEHWLXZXLKT-UHFFFAOYSA-N
XLogP3.49
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.33
LogP ≤ 53.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine 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

2-cyclopropyl-2-fluoro-2-(4-fluorophenyl)ethanamine
CID 112567178
1-amino-2-(4-cyclobutylphenyl)propan-2-ol
CID 116505464
2-cyclopropyl-2-(3,4-dichlorophenyl)-2-fluoroethanamine
CID 112567048
2-(4-ethylcyclohexyl)-2-fluoro-2-phenylethanamine
CID 112566374
2-(4-cyclobutylphenyl)butan-2-ol
CID 116505233
1-cyclohexyl-4-(1,1,2,2-tetrafluoroethyl)benzene
CID 23236608
[1-(4-cyclobutylphenyl)cyclopropyl]methanamine
CID 117290330
1-cyclohexyl-4-(1,1-difluoro-2-methylpropyl)benzene
CID 116841385
bis(4-cyclohexylphenyl)-[4-(trifluoromethyl)phenyl]sulfanium
CID 166005175
2-(4-cyclobutylphenyl)-1-cyclopropylpropan-2-ol
CID 116505508
(4-cyclohexylphenyl)methanamine
CID 22246867
2-(4-cyclobutylphenyl)-3,3-dimethylbutan-2-ol
CID 116505450

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine?
The IUPAC name of 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine (CID 116507146) is 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine.
What is the SMILES notation for 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine?
The canonical SMILES for 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine is NCC(F)(c1ccc(C2CCC2)cc1)C1CC1.
What is the InChIKey of 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine?
The InChIKey is KYQWEHWLXZXLKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FN/c16-15(10-17,14-8-9-14)13-6-4-12(5-7-13)11-2-1-3-11/h4-7,11,14H,1-3,8-10,17H2.
What are the key properties of 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine?
2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine has a molecular weight of 233.33 g/mol, XLogP of 3.49, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclobutylphenyl)-2-cyclopropyl-2-fluoroethanamine is sourced from PubChem (CID 116507146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).