3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide

C10H17F3N2O2 — CID 162584905

IUPAC3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide
SMILESNC(C1CCCC1)C(O)C(=O)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)5-15-9(17)8(16)7(14)6-3-1-2-4-6/h6-8,16H,1-5,14H2,(H,15,17)
InChIKeySUGVHXAMMXUXMU-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.54
Rot. Bonds4

About 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide

3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide (PubChem CID 162584905) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide.

Molecular Properties

Compound Name3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide
PubChem CID162584905
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide
SMILESNC(C1CCCC1)C(O)C(=O)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)5-15-9(17)8(16)7(14)6-3-1-2-4-6/h6-8,16H,1-5,14H2,(H,15,17)
InChIKeySUGVHXAMMXUXMU-UHFFFAOYSA-N
XLogP0.54
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.54
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide?
The IUPAC name of 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide (CID 162584905) is 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide.
What is the SMILES notation for 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide?
The canonical SMILES for 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide is NC(C1CCCC1)C(O)C(=O)NCC(F)(F)F.
What is the InChIKey of 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide?
The InChIKey is SUGVHXAMMXUXMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)5-15-9(17)8(16)7(14)6-3-1-2-4-6/h6-8,16H,1-5,14H2,(H,15,17).
What are the key properties of 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide?
3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide has a molecular weight of 254.25 g/mol, XLogP of 0.54, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-3-cyclopentyl-2-hydroxy-N-(2,2,2-trifluoroethyl)propanamide is sourced from PubChem (CID 162584905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).