N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide

C8H12F3NO2 — CID 43576883

IUPACN-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
SMILESO=C(CC(F)(F)F)N(CCO)C1CC1
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)5-7(14)12(3-4-13)6-1-2-6/h6,13H,1-5H2
InChIKeyMLFKREPICLDOJW-UHFFFAOYSA-N
MW211.18 g/mol
LogP0.92
Rot. Bonds4

About N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide

N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide (PubChem CID 43576883) has the molecular formula C8H12F3NO2 and a molecular weight of 211.18 g/mol. Its IUPAC name is N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide.

Molecular Properties

Compound NameN-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
PubChem CID43576883
Molecular FormulaC8H12F3NO2
Molecular Weight211.18 g/mol
Exact Mass211.08
IUPAC NameN-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide
SMILESO=C(CC(F)(F)F)N(CCO)C1CC1
InChIInChI=1S/C8H12F3NO2/c9-8(10,11)5-7(14)12(3-4-13)6-1-2-6/h6,13H,1-5H2
InChIKeyMLFKREPICLDOJW-UHFFFAOYSA-N
XLogP0.92
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.18
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-2,2,2-trifluoro-N-(2-hydroxyethyl)acetamide
CID 61448362
2,2,3,3,3-Pentafluoro-N-(2-hydroxyethyl)-N-methylpropanamide
CID 91730500
N-Ethyl-2,2,3,3,3-pentafluoro-N-(2-hydroxyethyl)propanamide
CID 91733399
N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyacetyl)acetamide
CID 162768562
3,3,3-trifluoro-N-(2-hydroxyethyl)-N-propan-2-ylpropanamide
CID 43573113
N-cyclopropyl-N-(2-hydroxyethyl)-3-(2,2,2-trifluoroethoxy)propanamide
CID 43577193
2,2,2-trifluoro-N-(2-hydroxyethyl)-N-propan-2-ylacetamide
CID 60999864
N-cyclopropyl-2,2,2-trifluoro-N-(2-hydroxyethyl)acetamide
CID 60999865
3,3,3-trifluoro-N,N-bis(2-hydroxyethyl)propanamide
CID 61235446
3,3,3-trifluoro-N-(2-hydroxyethyl)-N-pentan-3-ylpropanamide
CID 61581081
2,2,2-trifluoro-N-(2-hydroxyethyl)-N-pentan-3-ylacetamide
CID 61581990
N-cyclopropyl-2,2,2-trifluoro-N-(2-methoxyethyl)acetamide
CID 62728044

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The IUPAC name of N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide (CID 43576883) is N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide.
What is the SMILES notation for N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The canonical SMILES for N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide is O=C(CC(F)(F)F)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
The InChIKey is MLFKREPICLDOJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F3NO2/c9-8(10,11)5-7(14)12(3-4-13)6-1-2-6/h6,13H,1-5H2.
What are the key properties of N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide?
N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide has a molecular weight of 211.18 g/mol, XLogP of 0.92, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-3,3,3-trifluoro-N-(2-hydroxyethyl)propanamide is sourced from PubChem (CID 43576883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).