N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide

C12H21F3N2O — CID 104926640

IUPACN-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide
SMILESCCN(C)C(=O)CNC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H21F3N2O/c1-3-17(2)11(18)8-16-10-6-4-9(5-7-10)12(13,14)15/h9-10,16H,3-8H2,1-2H3
InChIKeyXKZQEDFUULQRCF-UHFFFAOYSA-N
MW266.31 g/mol
LogP2.18
Rot. Bonds4

About N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide

N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide (PubChem CID 104926640) has the molecular formula C12H21F3N2O and a molecular weight of 266.31 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide
PubChem CID104926640
Molecular FormulaC12H21F3N2O
Molecular Weight266.31 g/mol
Exact Mass266.16
IUPAC NameN-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide
SMILESCCN(C)C(=O)CNC1CCC(C(F)(F)F)CC1
InChIInChI=1S/C12H21F3N2O/c1-3-17(2)11(18)8-16-10-6-4-9(5-7-10)12(13,14)15/h9-10,16H,3-8H2,1-2H3
InChIKeyXKZQEDFUULQRCF-UHFFFAOYSA-N
XLogP2.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.31
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(4-tert-butylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 104923581
2-(cyclooctylamino)-N-ethyl-N-methylacetamide
CID 43309596
N-ethyl-N-methyl-2-[[1-(2,2,2-trifluoroethyl)piperidin-4-yl]amino]acetamide
CID 104926671
2-[(3,4-dimethylcyclohexyl)amino]-N-ethyl-N-methylacetamide
CID 64743255
4-[[2-[ethyl(methyl)amino]-2-oxoethyl]amino]piperidine-1-carboxamide
CID 104923445
2-[(4-tert-butylcyclohexyl)amino]-N,N-dimethylacetamide
CID 43214573
2-[(3,3-dimethylcyclopentyl)amino]-N-ethyl-N-methylacetamide
CID 114448902
N-ethyl-2-[[(1R,2R)-2-hydroxycyclohexyl]amino]-N-methylacetamide
CID 94415851
2-(cyclopropylamino)-N-(1-hydroxypropan-2-yl)-N-methylacetamide
CID 104551708
2-[(2,2-dimethyloxan-4-yl)amino]-N-ethyl-N-methylacetamide
CID 83033158
N,N-diethyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]propanamide
CID 64754869
N',N'-diethyl-N-[4-(trifluoromethyl)cyclohexyl]propane-1,3-diamine
CID 64756068

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide?
The IUPAC name of N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide (CID 104926640) is N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide is CCN(C)C(=O)CNC1CCC(C(F)(F)F)CC1.
What is the InChIKey of N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide?
The InChIKey is XKZQEDFUULQRCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21F3N2O/c1-3-17(2)11(18)8-16-10-6-4-9(5-7-10)12(13,14)15/h9-10,16H,3-8H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide?
N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide has a molecular weight of 266.31 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-[[4-(trifluoromethyl)cyclohexyl]amino]acetamide is sourced from PubChem (CID 104926640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).