2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide

C10H17F3N2O2 — CID 65111460

IUPAC2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNCC1(O)CCCC1)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-8(16)5-14-6-9(17)3-1-2-4-9/h14,17H,1-7H2,(H,15,16)
InChIKeyROUZSBZEKKFPFR-UHFFFAOYSA-N
MW254.25 g/mol
LogP0.56
Rot. Bonds5

About 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide

2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide (PubChem CID 65111460) has the molecular formula C10H17F3N2O2 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide.

Molecular Properties

Compound Name2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
PubChem CID65111460
Molecular FormulaC10H17F3N2O2
Molecular Weight254.25 g/mol
Exact Mass254.12
IUPAC Name2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide
SMILESO=C(CNCC1(O)CCCC1)NCC(F)(F)F
InChIInChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-8(16)5-14-6-9(17)3-1-2-4-9/h14,17H,1-7H2,(H,15,16)
InChIKeyROUZSBZEKKFPFR-UHFFFAOYSA-N
XLogP0.56
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 50.56
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide?
The IUPAC name of 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide (CID 65111460) is 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide.
What is the SMILES notation for 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide?
The canonical SMILES for 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide is O=C(CNCC1(O)CCCC1)NCC(F)(F)F.
What is the InChIKey of 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide?
The InChIKey is ROUZSBZEKKFPFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17F3N2O2/c11-10(12,13)7-15-8(16)5-14-6-9(17)3-1-2-4-9/h14,17H,1-7H2,(H,15,16).
What are the key properties of 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide?
2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide has a molecular weight of 254.25 g/mol, XLogP of 0.56, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-hydroxycyclopentyl)methylamino]-N-(2,2,2-trifluoroethyl)acetamide is sourced from PubChem (CID 65111460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).