N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide

C11H18F3NO2 — CID 54942567

IUPACN-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
SMILESO=C(CC(F)(F)F)N(CCO)C1CCCCC1
InChIInChI=1S/C11H18F3NO2/c12-11(13,14)8-10(17)15(6-7-16)9-4-2-1-3-5-9/h9,16H,1-8H2
InChIKeyVPLCFGJMKOCMOR-UHFFFAOYSA-N
MW253.26 g/mol
LogP2.09
Rot. Bonds4

About N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide

N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide (PubChem CID 54942567) has the molecular formula C11H18F3NO2 and a molecular weight of 253.26 g/mol. Its IUPAC name is N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
PubChem CID54942567
Molecular FormulaC11H18F3NO2
Molecular Weight253.26 g/mol
Exact Mass253.13
IUPAC NameN-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
SMILESO=C(CC(F)(F)F)N(CCO)C1CCCCC1
InChIInChI=1S/C11H18F3NO2/c12-11(13,14)8-10(17)15(6-7-16)9-4-2-1-3-5-9/h9,16H,1-8H2
InChIKeyVPLCFGJMKOCMOR-UHFFFAOYSA-N
XLogP2.09
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.26
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The IUPAC name of N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide (CID 54942567) is N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide is O=C(CC(F)(F)F)N(CCO)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The InChIKey is VPLCFGJMKOCMOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18F3NO2/c12-11(13,14)8-10(17)15(6-7-16)9-4-2-1-3-5-9/h9,16H,1-8H2.
What are the key properties of N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide has a molecular weight of 253.26 g/mol, XLogP of 2.09, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 54942567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).