N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide

C11H19F3N2O2 — CID 79260931

IUPACN-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NCC1CCCC1CO
InChIInChI=1S/C11H19F3N2O2/c12-11(13,14)7-15-5-10(18)16-4-8-2-1-3-9(8)6-17/h8-9,15,17H,1-7H2,(H,16,18)
InChIKeyBWZRTDRHYKIBSN-UHFFFAOYSA-N
MW268.28 g/mol
LogP0.66
Rot. Bonds6

About N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide

N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide (PubChem CID 79260931) has the molecular formula C11H19F3N2O2 and a molecular weight of 268.28 g/mol. Its IUPAC name is N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide.

Molecular Properties

Compound NameN-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
PubChem CID79260931
Molecular FormulaC11H19F3N2O2
Molecular Weight268.28 g/mol
Exact Mass268.14
IUPAC NameN-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide
SMILESO=C(CNCC(F)(F)F)NCC1CCCC1CO
InChIInChI=1S/C11H19F3N2O2/c12-11(13,14)7-15-5-10(18)16-4-8-2-1-3-9(8)6-17/h8-9,15,17H,1-7H2,(H,16,18)
InChIKeyBWZRTDRHYKIBSN-UHFFFAOYSA-N
XLogP0.66
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.28
LogP ≤ 50.66
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide 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-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The IUPAC name of N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide (CID 79260931) is N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide.
What is the SMILES notation for N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The canonical SMILES for N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide is O=C(CNCC(F)(F)F)NCC1CCCC1CO.
What is the InChIKey of N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
The InChIKey is BWZRTDRHYKIBSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2O2/c12-11(13,14)7-15-5-10(18)16-4-8-2-1-3-9(8)6-17/h8-9,15,17H,1-7H2,(H,16,18).
What are the key properties of N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide?
N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide has a molecular weight of 268.28 g/mol, XLogP of 0.66, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(hydroxymethyl)cyclopentyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide is sourced from PubChem (CID 79260931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).