ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine

C16H33F2NO — CID 176558044

IUPACethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine
SMILESCC.CCOC1CCC(C(F)(F)CN(CC)CC)CC1
InChIInChI=1S/C14H27F2NO.C2H6/c1-4-17(5-2)11-14(15,16)12-7-9-13(10-8-12)18-6-3;1-2/h12-13H,4-11H2,1-3H3;1-2H3
InChIKeyGAHSBAJCDLURSZ-UHFFFAOYSA-N
MW293.44 g/mol
LogP4.59
Rot. Bonds7

About ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine

ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine (PubChem CID 176558044) has the molecular formula C16H33F2NO and a molecular weight of 293.44 g/mol. Its IUPAC name is ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine.

Molecular Properties

Compound Nameethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine
PubChem CID176558044
Molecular FormulaC16H33F2NO
Molecular Weight293.44 g/mol
Exact Mass293.25
IUPAC Nameethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine
SMILESCC.CCOC1CCC(C(F)(F)CN(CC)CC)CC1
InChIInChI=1S/C14H27F2NO.C2H6/c1-4-17(5-2)11-14(15,16)12-7-9-13(10-8-12)18-6-3;1-2/h12-13H,4-11H2,1-3H3;1-2H3
InChIKeyGAHSBAJCDLURSZ-UHFFFAOYSA-N
XLogP4.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.44
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-1-propan-2-yl-4-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170372624
(2R)-1-propan-2-yl-4-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170372627
(2R)-1-propan-2-yl-4-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170372798
(2S)-1-propan-2-yl-4-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170372801
4-Propan-2-yl-1-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170372974
(2R)-4-propan-2-yl-1-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170372976
(2S)-4-propan-2-yl-1-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170372980
4-Propan-2-yl-1-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170372982
(2R)-4-propan-2-yl-1-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170372984
(2S)-4-propan-2-yl-1-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170372986
1-Propan-2-yl-4-[4-(4-propan-2-yloxycyclohexyl)butyl]-2-(trifluoromethyl)piperazine
CID 170375379
1-Propan-2-yl-4-[3-(4-propan-2-yloxycyclohexyl)propyl]-2-(trifluoromethyl)piperazine
CID 170529567

Frequently Asked Questions

What is the IUPAC name of ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine?
The IUPAC name of ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine (CID 176558044) is ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine.
What is the SMILES notation for ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine?
The canonical SMILES for ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine is CC.CCOC1CCC(C(F)(F)CN(CC)CC)CC1.
What is the InChIKey of ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine?
The InChIKey is GAHSBAJCDLURSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27F2NO.C2H6/c1-4-17(5-2)11-14(15,16)12-7-9-13(10-8-12)18-6-3;1-2/h12-13H,4-11H2,1-3H3;1-2H3.
What are the key properties of ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine?
ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine has a molecular weight of 293.44 g/mol, XLogP of 4.59, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-(4-ethoxycyclohexyl)-N,N-diethyl-2,2-difluoroethanamine is sourced from PubChem (CID 176558044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).