2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine

C14H24F3NO — CID 82711226

IUPAC2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
SMILESFC(F)(F)CONC1CCCCC1C1CCCCC1
InChIInChI=1S/C14H24F3NO/c15-14(16,17)10-19-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h11-13,18H,1-10H2
InChIKeyUDNFBICUMDZFSC-UHFFFAOYSA-N
MW279.35 g/mol
LogP4.21
Rot. Bonds4

About 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine

2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine (PubChem CID 82711226) has the molecular formula C14H24F3NO and a molecular weight of 279.35 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine.

Molecular Properties

Compound Name2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
PubChem CID82711226
Molecular FormulaC14H24F3NO
Molecular Weight279.35 g/mol
Exact Mass279.18
IUPAC Name2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
SMILESFC(F)(F)CONC1CCCCC1C1CCCCC1
InChIInChI=1S/C14H24F3NO/c15-14(16,17)10-19-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h11-13,18H,1-10H2
InChIKeyUDNFBICUMDZFSC-UHFFFAOYSA-N
XLogP4.21
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.35
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N-ethoxy-2-(trifluoromethyl)cyclohexan-1-amine
CID 82709358
N-(2,2,2-trifluoroethoxy)adamantan-2-amine
CID 82710674
2-cyclohexyl-N-(2,2,2-trifluoroethoxy)ethanamine
CID 82710866
4-propan-2-yl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82710902
4-tert-butyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711113
3-ethyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711132
3,5-dimethyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711229
2-propan-2-yl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711242
3-cyclopropyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711341
2-ethyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711458
2,3-dimethyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711465
2-(aminomethyl)-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine
CID 82711480

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine?
The IUPAC name of 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine (CID 82711226) is 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine.
What is the SMILES notation for 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine?
The canonical SMILES for 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine is FC(F)(F)CONC1CCCCC1C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine?
The InChIKey is UDNFBICUMDZFSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24F3NO/c15-14(16,17)10-19-18-13-9-5-4-8-12(13)11-6-2-1-3-7-11/h11-13,18H,1-10H2.
What are the key properties of 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine?
2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine has a molecular weight of 279.35 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2,2,2-trifluoroethoxy)cyclohexan-1-amine is sourced from PubChem (CID 82711226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).