(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine

C7H10F3N — CID 124552364

IUPAC(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine
SMILESN[C@H]1CC=C(C(F)(F)F)CC1
InChIInChI=1S/C7H10F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1,6H,2-4,11H2/t6-/m0/s1
InChIKeyYRTQUAARSDUSBI-LURJTMIESA-N
MW165.16 g/mol
LogP1.99
Rot. Bonds

About (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine

(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine (PubChem CID 124552364) has the molecular formula C7H10F3N and a molecular weight of 165.16 g/mol. Its IUPAC name is (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine.

Molecular Properties

Compound Name(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine
PubChem CID124552364
Molecular FormulaC7H10F3N
Molecular Weight165.16 g/mol
Exact Mass165.08
IUPAC Name(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine
SMILESN[C@H]1CC=C(C(F)(F)F)CC1
InChIInChI=1S/C7H10F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1,6H,2-4,11H2/t6-/m0/s1
InChIKeyYRTQUAARSDUSBI-LURJTMIESA-N
XLogP1.99
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.16
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (1R)-4-(trifluoromethyl)cyclohex-3-en-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 (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine?
The IUPAC name of (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine (CID 124552364) is (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine.
What is the SMILES notation for (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine?
The canonical SMILES for (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine is N[C@H]1CC=C(C(F)(F)F)CC1.
What is the InChIKey of (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine?
The InChIKey is YRTQUAARSDUSBI-LURJTMIESA-N. The full InChI is InChI=1S/C7H10F3N/c8-7(9,10)5-1-3-6(11)4-2-5/h1,6H,2-4,11H2/t6-/m0/s1.
What are the key properties of (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine?
(1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine has a molecular weight of 165.16 g/mol, XLogP of 1.99, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-4-(trifluoromethyl)cyclohex-3-en-1-amine is sourced from PubChem (CID 124552364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).