2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

C10H17F3N2O2 — CID 103917411

IUPAC2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOC1CC(NCC(=O)NCC(F)(F)F)C1
InChIInChI=1S/C10H17F3N2O2/c1-2-17-8-3-7(4-8)14-5-9(16)15-6-10(11,12)13/h7-8,14H,2-6H2,1H3,(H,15,16)
InChIKeyLIIXBSHUHBCUFV-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.82
Rot. Bonds6

About 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide

2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 103917411) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID103917411
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESCCOC1CC(NCC(=O)NCC(F)(F)F)C1
InChIInChI=1S/C10H17F3N2O2/c1-2-17-8-3-7(4-8)14-5-9(16)15-6-10(11,12)13/h7-8,14H,2-6H2,1H3,(H,15,16)
InChIKeyLIIXBSHUHBCUFV-UHFFFAOYSA-N
XLogP0.82
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide (CID 103917411) is 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is CCOC1CC(NCC(=O)NCC(F)(F)F)C1.
What is the InChIKey of 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is LIIXBSHUHBCUFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c1-2-17-8-3-7(4-8)14-5-9(16)15-6-10(11,12)13/h7-8,14H,2-6H2,1H3,(H,15,16).
What are the key properties of 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-ethoxycyclobutyl)amino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 103917411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).