N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine

C10H14F7N — CID 104934178

IUPACN-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine
SMILESFC(F)C(F)(F)CNC1CCCCC1C(F)(F)F
InChIInChI=1S/C10H14F7N/c11-8(12)9(13,14)5-18-7-4-2-1-3-6(7)10(15,16)17/h6-8,18H,1-5H2
InChIKeyILHPFQUXXMRECC-UHFFFAOYSA-N
MW281.22 g/mol
LogP3.60
Rot. Bonds4

About N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine

N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine (PubChem CID 104934178) has the molecular formula C10H14F7N and a molecular weight of 281.22 g/mol. Its IUPAC name is N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine.

Molecular Properties

Compound NameN-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine
PubChem CID104934178
Molecular FormulaC10H14F7N
Molecular Weight281.22 g/mol
Exact Mass281.10
IUPAC NameN-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine
SMILESFC(F)C(F)(F)CNC1CCCCC1C(F)(F)F
InChIInChI=1S/C10H14F7N/c11-8(12)9(13,14)5-18-7-4-2-1-3-6(7)10(15,16)17/h6-8,18H,1-5H2
InChIKeyILHPFQUXXMRECC-UHFFFAOYSA-N
XLogP3.60
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.22
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(2,2-difluoroethyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 115406111
N-(2-methylpropyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 43434483
2-ethyl-N-(2,2,3,3-tetrafluoropropyl)cyclopentan-1-amine
CID 106289421
N'-[2-(trifluoromethyl)cyclohexyl]propane-1,3-diamine
CID 64759304
2-(trifluoromethyl)-N-(3,3,3-trifluoropropyl)cyclohexan-1-amine
CID 64756873
2-[[2-(trifluoromethyl)cyclohexyl]amino]ethanol
CID 64759490
2-pyrrolidin-2-yl-N-(2,2,3,3-tetrafluoropropyl)cyclopentan-1-amine
CID 106289452
2-tert-butyl-N-(2,2,2-trifluoroethyl)cyclohexan-1-amine
CID 43079272
N-propan-2-yl-2-[[2-(trifluoromethyl)cyclohexyl]amino]acetamide
CID 64758473
N-(3-methylbut-2-enyl)-2-(trifluoromethyl)cyclohexan-1-amine
CID 104934180
2-[[2-(trifluoromethyl)cyclohexyl]amino]acetamide
CID 64757047
trans-(1S,2S)-N-methyl-2-(trifluoromethyl)cyclohexan-1-amine
CID 124508980

Frequently Asked Questions

What is the IUPAC name of N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine?
The IUPAC name of N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine (CID 104934178) is N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine.
What is the SMILES notation for N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine?
The canonical SMILES for N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine is FC(F)C(F)(F)CNC1CCCCC1C(F)(F)F.
What is the InChIKey of N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine?
The InChIKey is ILHPFQUXXMRECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F7N/c11-8(12)9(13,14)5-18-7-4-2-1-3-6(7)10(15,16)17/h6-8,18H,1-5H2.
What are the key properties of N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine?
N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine has a molecular weight of 281.22 g/mol, XLogP of 3.60, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2,3,3-tetrafluoropropyl)-2-(trifluoromethyl)cyclohexan-1-amine is sourced from PubChem (CID 104934178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).