3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide

C10H13F6NO2 — CID 103310246

IUPAC3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide
SMILESO=C(NCC1(CCO)CC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H13F6NO2/c11-9(12,13)6(10(14,15)16)7(19)17-5-8(1-2-8)3-4-18/h6,18H,1-5H2,(H,17,19)
InChIKeyYBERYEPOEUJAQG-UHFFFAOYSA-N
MW293.21 g/mol
LogP2.01
Rot. Bonds5

About 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide

3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide (PubChem CID 103310246) has the molecular formula C10H13F6NO2 and a molecular weight of 293.21 g/mol. Its IUPAC name is 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide.

Molecular Properties

Compound Name3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide
PubChem CID103310246
Molecular FormulaC10H13F6NO2
Molecular Weight293.21 g/mol
Exact Mass293.09
IUPAC Name3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide
SMILESO=C(NCC1(CCO)CC1)C(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C10H13F6NO2/c11-9(12,13)6(10(14,15)16)7(19)17-5-8(1-2-8)3-4-18/h6,18H,1-5H2,(H,17,19)
InChIKeyYBERYEPOEUJAQG-UHFFFAOYSA-N
XLogP2.01
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.21
LogP ≤ 52.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-ethyl-4-hydroxybutyl)-3,3,3-trifluoropropanamide
CID 80308123
N-(2-ethyl-4-hydroxybutyl)-4,4,4-trifluorobutanamide
CID 80308442
N-(2-ethyl-4-hydroxybutyl)-2,2,2-trifluoroacetamide
CID 80308620
4,4,4-trifluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]butanamide
CID 80716729
3,3,3-trifluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]propanamide
CID 80716737
3,3,3-trifluoro-N-(4-hydroxy-2-methylbutyl)-2-(trifluoromethyl)propanamide
CID 103310203
3,3,3-trifluoro-N-(5-hydroxypentan-2-yl)-2-(trifluoromethyl)propanamide
CID 103310214
N-(2-ethyl-4-hydroxybutyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103310215
N-(2-ethyl-4-hydroxybutyl)-2,2-difluoroacetamide
CID 103513968
2,2-difluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]acetamide
CID 103514010
N-(2-ethyl-4-hydroxybutyl)-2,2,3,3-tetrafluoropropanamide
CID 103771914
2,2,3,3-tetrafluoro-N-[[1-(hydroxymethyl)cyclopropyl]methyl]propanamide
CID 103771933

Frequently Asked Questions

What is the IUPAC name of 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide?
The IUPAC name of 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide (CID 103310246) is 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide.
What is the SMILES notation for 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide?
The canonical SMILES for 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide is O=C(NCC1(CCO)CC1)C(C(F)(F)F)C(F)(F)F.
What is the InChIKey of 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide?
The InChIKey is YBERYEPOEUJAQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F6NO2/c11-9(12,13)6(10(14,15)16)7(19)17-5-8(1-2-8)3-4-18/h6,18H,1-5H2,(H,17,19).
What are the key properties of 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide?
3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide has a molecular weight of 293.21 g/mol, XLogP of 2.01, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoro-N-[[1-(2-hydroxyethyl)cyclopropyl]methyl]-2-(trifluoromethyl)propanamide is sourced from PubChem (CID 103310246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).