N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide

C11H10F3NO — CID 110487434

IUPACN-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)c(F)c1F)NC1CC1
InChIInChI=1S/C11H10F3NO/c12-8-4-1-6(10(13)11(8)14)5-9(16)15-7-2-3-7/h1,4,7H,2-3,5H2,(H,15,16)
InChIKeyBHVXOKDARAOIEY-UHFFFAOYSA-N
MW229.20 g/mol
LogP1.92
Rot. Bonds3

About N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide

N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide (PubChem CID 110487434) has the molecular formula C11H10F3NO and a molecular weight of 229.20 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide
PubChem CID110487434
Molecular FormulaC11H10F3NO
Molecular Weight229.20 g/mol
Exact Mass229.07
IUPAC NameN-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide
SMILESO=C(Cc1ccc(F)c(F)c1F)NC1CC1
InChIInChI=1S/C11H10F3NO/c12-8-4-1-6(10(13)11(8)14)5-9(16)15-7-2-3-7/h1,4,7H,2-3,5H2,(H,15,16)
InChIKeyBHVXOKDARAOIEY-UHFFFAOYSA-N
XLogP1.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(4-chloro-2-fluorophenyl)-N-cyclopropylacetamide
CID 56920036
N-[(2,3,4-trifluorophenyl)methyl]cyclopropanamine
CID 63969871
2-(2,5-difluorophenyl)-N-(4-hydroxycyclohexyl)acetamide
CID 111470021
N-cyclobutyl-2-(2-fluoro-5-hydroxyphenyl)acetamide
CID 166638927
N-(4-aminocyclohexyl)-2-(2-fluorophenyl)acetamide
CID 43653105
2-(2-fluorophenyl)-N-[4-(hydroxymethyl)cyclohexyl]acetamide
CID 115270081
N-[(2,3,4-trifluorophenyl)methyl]propanamide
CID 110477463
2,3,4-trifluoro-N-[4-(methylamino)cyclohexyl]benzamide
CID 79749208
2-(4-chlorophenyl)-N-[1-(2,3,4-trifluorobenzoyl)piperidin-4-yl]acetamide
CID 108566655
N-cyclopropyl-2-phenylacetamide
CID 5175687
N-(4-aminocyclohexyl)-2-(2,4-dichlorophenyl)acetamide;hydrochloride
CID 119474323
2-(cyclopropylamino)-N-(2,3,4-trifluorophenyl)acetamide
CID 60647160

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide (CID 110487434) is N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide is O=C(Cc1ccc(F)c(F)c1F)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide?
The InChIKey is BHVXOKDARAOIEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3NO/c12-8-4-1-6(10(13)11(8)14)5-9(16)15-7-2-3-7/h1,4,7H,2-3,5H2,(H,15,16).
What are the key properties of N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide?
N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide has a molecular weight of 229.20 g/mol, XLogP of 1.92, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,3,4-trifluorophenyl)acetamide is sourced from PubChem (CID 110487434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).