N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide

C10H16F3NO — CID 20699941

IUPACN-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide
SMILESO=C(NCCC1CCCCC1)C(F)(F)F
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)14-7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,14,15)
InChIKeyPPWHPMWJMAIIFL-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.64
Rot. Bonds3

About N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide

N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide (PubChem CID 20699941) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide.

Molecular Properties

Compound NameN-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide
PubChem CID20699941
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC NameN-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide
SMILESO=C(NCCC1CCCCC1)C(F)(F)F
InChIInChI=1S/C10H16F3NO/c11-10(12,13)9(15)14-7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,14,15)
InChIKeyPPWHPMWJMAIIFL-UHFFFAOYSA-N
XLogP2.64
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.24
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide?
The IUPAC name of N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide (CID 20699941) is N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide.
What is the SMILES notation for N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide?
The canonical SMILES for N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide is O=C(NCCC1CCCCC1)C(F)(F)F.
What is the InChIKey of N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide?
The InChIKey is PPWHPMWJMAIIFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c11-10(12,13)9(15)14-7-6-8-4-2-1-3-5-8/h8H,1-7H2,(H,14,15).
What are the key properties of N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide?
N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide has a molecular weight of 223.24 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclohexylethyl)-2,2,2-trifluoroacetamide is sourced from PubChem (CID 20699941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).