3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine

C8H14F3N — CID 80699598

IUPAC3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC1(C)CCC(N)(C(F)(F)F)C1
InChIInChI=1S/C8H14F3N/c1-6(2)3-4-7(12,5-6)8(9,10)11/h3-5,12H2,1-2H3
InChIKeyXDZFNHRTWSYVEE-UHFFFAOYSA-N
MW181.20 g/mol
LogP2.46
Rot. Bonds

About 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine

3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine (PubChem CID 80699598) has the molecular formula C8H14F3N and a molecular weight of 181.20 g/mol. Its IUPAC name is 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine.

Molecular Properties

Compound Name3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine
PubChem CID80699598
Molecular FormulaC8H14F3N
Molecular Weight181.20 g/mol
Exact Mass181.11
IUPAC Name3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine
SMILESCC1(C)CCC(N)(C(F)(F)F)C1
InChIInChI=1S/C8H14F3N/c1-6(2)3-4-7(12,5-6)8(9,10)11/h3-5,12H2,1-2H3
InChIKeyXDZFNHRTWSYVEE-UHFFFAOYSA-N
XLogP2.46
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,3-Difluoro-1-methylcyclopentan-1-amine
CID 84762419
1,1,1-Trifluoro-2,4,4-trimethylhexan-2-amine
CID 166671386
4-(Trifluoromethyl)bicyclo[2.1.1]hexan-1-amine
CID 169888395
trans-(1R,3S)-1-methyl-3-(trifluoromethyl)cyclopentan-1-amine
CID 174036116
3-Methyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 64513626
3-Ethyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 64513627
1-(Difluoromethyl)-3-methylcyclopentan-1-amine
CID 80604542
1-(Difluoromethyl)-3-ethylcyclopentan-1-amine
CID 80605012
1-(Difluoromethyl)-3,3-dimethylcyclopentan-1-amine
CID 80699833
2,2-Difluoro-1-methylcyclopentan-1-amine
CID 105427844
2,4,4-Trimethyl-1-(trifluoromethyl)cyclopentan-1-amine
CID 106664135
1-(Difluoromethyl)-2,4,4-trimethylcyclopentan-1-amine
CID 106664139

Frequently Asked Questions

What is the IUPAC name of 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine?
The IUPAC name of 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine (CID 80699598) is 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine.
What is the SMILES notation for 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine?
The canonical SMILES for 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine is CC1(C)CCC(N)(C(F)(F)F)C1.
What is the InChIKey of 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine?
The InChIKey is XDZFNHRTWSYVEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F3N/c1-6(2)3-4-7(12,5-6)8(9,10)11/h3-5,12H2,1-2H3.
What are the key properties of 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine?
3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine has a molecular weight of 181.20 g/mol, XLogP of 2.46, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethyl-1-(trifluoromethyl)cyclopentan-1-amine is sourced from PubChem (CID 80699598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).