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

C13H20F3NO — CID 75502533

IUPACN-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide
SMILESCN(C(=O)CC1CCC(C(F)(F)F)CC1)C1CC1
InChIInChI=1S/C13H20F3NO/c1-17(11-6-7-11)12(18)8-9-2-4-10(5-3-9)13(14,15)16/h9-11H,2-8H2,1H3
InChIKeySEKJUENHIIBTJK-UHFFFAOYSA-N
MW263.30 g/mol
LogP3.37
Rot. Bonds3

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

N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide (PubChem CID 75502533) has the molecular formula C13H20F3NO and a molecular weight of 263.30 g/mol. Its IUPAC name is N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide
PubChem CID75502533
Molecular FormulaC13H20F3NO
Molecular Weight263.30 g/mol
Exact Mass263.15
IUPAC NameN-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide
SMILESCN(C(=O)CC1CCC(C(F)(F)F)CC1)C1CC1
InChIInChI=1S/C13H20F3NO/c1-17(11-6-7-11)12(18)8-9-2-4-10(5-3-9)13(14,15)16/h9-11H,2-8H2,1H3
InChIKeySEKJUENHIIBTJK-UHFFFAOYSA-N
XLogP3.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.30
LogP ≤ 53.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylacetamide
CID 116817264
2-[cyclopropyl-[2-[4-(trifluoromethyl)cyclohexyl]acetyl]amino]acetic acid
CID 120517533
N-[4-(hydroxymethyl)cyclohexyl]-N-methyl-2-(oxan-4-yl)acetamide
CID 115277339
N-(4-cyanocyclohexyl)-2-cyclohexyl-N-methylacetamide
CID 116817101
N-(4-aminocyclohexyl)-N-methyl-2-(oxan-4-yl)acetamide
CID 115277521
N-methyl-N-[(2S)-2-(2H-tetrazol-5-yl)propyl]-2-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 99605343
N-ethyl-N-[4-(trifluoromethyl)cyclohexyl]acetamide
CID 162576485
N-(4-ethylcyclohexyl)-N-methyl-2-piperidin-3-ylacetamide
CID 62689864
N-(4-hydroxycyclohexyl)-N-methyl-2-(1-methylpiperidin-4-yl)acetamide
CID 115277428
2-(azetidin-3-yl)-N-cyclobutyl-N-methylacetamide
CID 115739566
3-cyclobutyl-N-[4-(2-hydroxyethyl)cyclohexyl]-N-methylpropanamide
CID 116817268
N,N-dimethyl-1-[4-(trifluoromethyl)cyclohexyl]methanamine
CID 139711377

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide?
The IUPAC name of N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide (CID 75502533) is N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide.
What is the SMILES notation for N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide?
The canonical SMILES for N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide is CN(C(=O)CC1CCC(C(F)(F)F)CC1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide?
The InChIKey is SEKJUENHIIBTJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20F3NO/c1-17(11-6-7-11)12(18)8-9-2-4-10(5-3-9)13(14,15)16/h9-11H,2-8H2,1H3.
What are the key properties of N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide?
N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide has a molecular weight of 263.30 g/mol, XLogP of 3.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-methyl-2-[4-(trifluoromethyl)cyclohexyl]acetamide is sourced from PubChem (CID 75502533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).