2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide

C9H14F3NO2 — CID 111430467

IUPAC2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCC(F)(F)F
InChIInChI=1S/C9H14F3NO2/c10-9(11,12)6-13-7(14)5-8(15)3-1-2-4-8/h15H,1-6H2,(H,13,14)
InChIKeyBKLDRKFKCQYDJO-UHFFFAOYSA-N
MW225.21 g/mol
LogP1.36
Rot. Bonds3

About 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide

2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 111430467) has the molecular formula C9H14F3NO2 and a molecular weight of 225.21 g/mol. Its IUPAC name is 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID111430467
Molecular FormulaC9H14F3NO2
Molecular Weight225.21 g/mol
Exact Mass225.10
IUPAC Name2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CC1(O)CCCC1)NCC(F)(F)F
InChIInChI=1S/C9H14F3NO2/c10-9(11,12)6-13-7(14)5-8(15)3-1-2-4-8/h15H,1-6H2,(H,13,14)
InChIKeyBKLDRKFKCQYDJO-UHFFFAOYSA-N
XLogP1.36
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.21
LogP ≤ 51.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide (CID 111430467) is 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide is O=C(CC1(O)CCCC1)NCC(F)(F)F.
What is the InChIKey of 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is BKLDRKFKCQYDJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14F3NO2/c10-9(11,12)6-13-7(14)5-8(15)3-1-2-4-8/h15H,1-6H2,(H,13,14).
What are the key properties of 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide?
2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 225.21 g/mol, XLogP of 1.36, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxycyclopentyl)-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 111430467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).