1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide

C10H16F3NO — CID 71111906

IUPAC1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
SMILESCCC1(C(=O)NCC(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)8(15)14-7-10(11,12)13/h2-7H2,1H3,(H,14,15)
InChIKeyNDXBSWMFHMJXGF-UHFFFAOYSA-N
MW223.24 g/mol
LogP2.64
Rot. Bonds3

About 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide

1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide (PubChem CID 71111906) has the molecular formula C10H16F3NO and a molecular weight of 223.24 g/mol. Its IUPAC name is 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
PubChem CID71111906
Molecular FormulaC10H16F3NO
Molecular Weight223.24 g/mol
Exact Mass223.12
IUPAC Name1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide
SMILESCCC1(C(=O)NCC(F)(F)F)CCCC1
InChIInChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)8(15)14-7-10(11,12)13/h2-7H2,1H3,(H,14,15)
InChIKeyNDXBSWMFHMJXGF-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 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The IUPAC name of 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide (CID 71111906) is 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide is CCC1(C(=O)NCC(F)(F)F)CCCC1.
What is the InChIKey of 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
The InChIKey is NDXBSWMFHMJXGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3NO/c1-2-9(5-3-4-6-9)8(15)14-7-10(11,12)13/h2-7H2,1H3,(H,14,15).
What are the key properties of 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide?
1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide 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 1-ethyl-N-(2,2,2-trifluoroethyl)cyclopentane-1-carboxamide is sourced from PubChem (CID 71111906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).