3-methyl-1-(trifluoromethyl)cyclopentan-1-amine

C7H12F3N — CID 64513626

IUPAC3-methyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC1CCC(N)(C(F)(F)F)C1
InChIInChI=1S/C7H12F3N/c1-5-2-3-6(11,4-5)7(8,9)10/h5H,2-4,11H2,1H3
InChIKeyREKKQDFVFMLYKN-UHFFFAOYSA-N
MW167.17 g/mol
LogP2.07
Rot. Bonds

About 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine

3-methyl-1-(trifluoromethyl)cyclopentan-1-amine (PubChem CID 64513626) has the molecular formula C7H12F3N and a molecular weight of 167.17 g/mol. Its IUPAC name is 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3-methyl-1-(trifluoromethyl)cyclopentan-1-amine
PubChem CID64513626
Molecular FormulaC7H12F3N
Molecular Weight167.17 g/mol
Exact Mass167.09
IUPAC Name3-methyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC1CCC(N)(C(F)(F)F)C1
InChIInChI=1S/C7H12F3N/c1-5-2-3-6(11,4-5)7(8,9)10/h5H,2-4,11H2,1H3
InChIKeyREKKQDFVFMLYKN-UHFFFAOYSA-N
XLogP2.07
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine?
The IUPAC name of 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine (CID 64513626) is 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine.
What is the SMILES notation for 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine?
The canonical SMILES for 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine is CC1CCC(N)(C(F)(F)F)C1.
What is the InChIKey of 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine?
The InChIKey is REKKQDFVFMLYKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3N/c1-5-2-3-6(11,4-5)7(8,9)10/h5H,2-4,11H2,1H3.
What are the key properties of 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine?
3-methyl-1-(trifluoromethyl)cyclopentan-1-amine has a molecular weight of 167.17 g/mol, XLogP of 2.07, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(trifluoromethyl)cyclopentan-1-amine is sourced from PubChem (CID 64513626), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).