3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine

C11H20F3N — CID 103907151

IUPAC3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine
SMILESCC(CC(F)(F)F)NC1CCC(C)(C)C1
InChIInChI=1S/C11H20F3N/c1-8(6-11(12,13)14)15-9-4-5-10(2,3)7-9/h8-9,15H,4-7H2,1-3H3
InChIKeyGAWUEFFOAGIEBP-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.50
Rot. Bonds3

About 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine

3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine (PubChem CID 103907151) has the molecular formula C11H20F3N and a molecular weight of 223.28 g/mol. Its IUPAC name is 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine
PubChem CID103907151
Molecular FormulaC11H20F3N
Molecular Weight223.28 g/mol
Exact Mass223.15
IUPAC Name3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine
SMILESCC(CC(F)(F)F)NC1CCC(C)(C)C1
InChIInChI=1S/C11H20F3N/c1-8(6-11(12,13)14)15-9-4-5-10(2,3)7-9/h8-9,15H,4-7H2,1-3H3
InChIKeyGAWUEFFOAGIEBP-UHFFFAOYSA-N
XLogP3.50
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine (CID 103907151) is 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine is CC(CC(F)(F)F)NC1CCC(C)(C)C1.
What is the InChIKey of 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine?
The InChIKey is GAWUEFFOAGIEBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F3N/c1-8(6-11(12,13)14)15-9-4-5-10(2,3)7-9/h8-9,15H,4-7H2,1-3H3.
What are the key properties of 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine?
3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine has a molecular weight of 223.28 g/mol, XLogP of 3.50, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-N-(4,4,4-trifluorobutan-2-yl)cyclopentan-1-amine is sourced from PubChem (CID 103907151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).