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

C7H12F3N — CID 83914428

IUPACN-methyl-3-(trifluoromethyl)cyclopentan-1-amine
SMILESCNC1CCC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3N/c1-11-6-3-2-5(4-6)7(8,9)10/h5-6,11H,2-4H2,1H3
InChIKeySVQZKVHUQZWRJJ-UHFFFAOYSA-N
MW167.17 g/mol
LogP1.94
Rot. Bonds1

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

N-methyl-3-(trifluoromethyl)cyclopentan-1-amine (PubChem CID 83914428) has the molecular formula C7H12F3N and a molecular weight of 167.17 g/mol. Its IUPAC name is N-methyl-3-(trifluoromethyl)cyclopentan-1-amine.

Molecular Properties

Compound NameN-methyl-3-(trifluoromethyl)cyclopentan-1-amine
PubChem CID83914428
Molecular FormulaC7H12F3N
Molecular Weight167.17 g/mol
Exact Mass167.09
IUPAC NameN-methyl-3-(trifluoromethyl)cyclopentan-1-amine
SMILESCNC1CCC(C(F)(F)F)C1
InChIInChI=1S/C7H12F3N/c1-11-6-3-2-5(4-6)7(8,9)10/h5-6,11H,2-4H2,1H3
InChIKeySVQZKVHUQZWRJJ-UHFFFAOYSA-N
XLogP1.94
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.17
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(trifluoromethyl)cyclopentan-1-amine?
The IUPAC name of N-methyl-3-(trifluoromethyl)cyclopentan-1-amine (CID 83914428) is N-methyl-3-(trifluoromethyl)cyclopentan-1-amine.
What is the SMILES notation for N-methyl-3-(trifluoromethyl)cyclopentan-1-amine?
The canonical SMILES for N-methyl-3-(trifluoromethyl)cyclopentan-1-amine is CNC1CCC(C(F)(F)F)C1.
What is the InChIKey of N-methyl-3-(trifluoromethyl)cyclopentan-1-amine?
The InChIKey is SVQZKVHUQZWRJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F3N/c1-11-6-3-2-5(4-6)7(8,9)10/h5-6,11H,2-4H2,1H3.
What are the key properties of N-methyl-3-(trifluoromethyl)cyclopentan-1-amine?
N-methyl-3-(trifluoromethyl)cyclopentan-1-amine has a molecular weight of 167.17 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(trifluoromethyl)cyclopentan-1-amine is sourced from PubChem (CID 83914428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).