2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine

C13H18FN — CID 114348186

IUPAC2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine
SMILESCc1cc(F)ccc1CC(N)C1(C)CC1
InChIInChI=1S/C13H18FN/c1-9-7-11(14)4-3-10(9)8-12(15)13(2)5-6-13/h3-4,7,12H,5-6,8,15H2,1-2H3
InChIKeyJNWRDAPAFUTSMX-UHFFFAOYSA-N
MW207.29 g/mol
LogP2.80
Rot. Bonds3

About 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine

2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine (PubChem CID 114348186) has the molecular formula C13H18FN and a molecular weight of 207.29 g/mol. Its IUPAC name is 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine.

Molecular Properties

Compound Name2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine
PubChem CID114348186
Molecular FormulaC13H18FN
Molecular Weight207.29 g/mol
Exact Mass207.14
IUPAC Name2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine
SMILESCc1cc(F)ccc1CC(N)C1(C)CC1
InChIInChI=1S/C13H18FN/c1-9-7-11(14)4-3-10(9)8-12(15)13(2)5-6-13/h3-4,7,12H,5-6,8,15H2,1-2H3
InChIKeyJNWRDAPAFUTSMX-UHFFFAOYSA-N
XLogP2.80
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.29
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine 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-(4-fluoro-2-methylphenyl)-1-(1-phenylcyclobutyl)ethanamine
CID 114347866
[2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethyl]hydrazine
CID 105253513
2-(2-bromo-5-fluorophenyl)-1-(1-methylcyclopentyl)ethanamine
CID 115843507
2-(3,5-difluorophenyl)-1-(1-methylcyclopropyl)ethanamine
CID 105406717
1-cyclopropyl-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114347649
1-(4,4-difluorocyclohexyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 105188329
1,2-bis(4-fluoro-2-methylphenyl)ethanamine
CID 114348216
2-amino-3-(4-fluoro-2-methylphenyl)propan-1-ol
CID 115649532
1-(4-fluoro-2-methylphenyl)-3-(2-methylphenyl)propan-2-amine
CID 114347770
5-(4-fluoro-2-methylphenyl)-4-methylpentan-2-amine
CID 114349415
1-(4-fluoro-2-methylphenyl)-3-(4-fluorophenyl)propan-2-amine
CID 114347641
1-(1-ethoxy-3-methylcyclohexyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114348409

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine?
The IUPAC name of 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine (CID 114348186) is 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine.
What is the SMILES notation for 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine?
The canonical SMILES for 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine is Cc1cc(F)ccc1CC(N)C1(C)CC1.
What is the InChIKey of 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine?
The InChIKey is JNWRDAPAFUTSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18FN/c1-9-7-11(14)4-3-10(9)8-12(15)13(2)5-6-13/h3-4,7,12H,5-6,8,15H2,1-2H3.
What are the key properties of 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine?
2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine has a molecular weight of 207.29 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoro-2-methylphenyl)-1-(1-methylcyclopropyl)ethanamine is sourced from PubChem (CID 114348186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).