N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide

C14H17F3N2O — CID 62815906

IUPACN-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESO=C(CNc1cc(F)c(F)cc1F)NC1CCCCC1
InChIInChI=1S/C14H17F3N2O/c15-10-6-12(17)13(7-11(10)16)18-8-14(20)19-9-4-2-1-3-5-9/h6-7,9,18H,1-5,8H2,(H,19,20)
InChIKeyNWXZBOVOEQFYDT-UHFFFAOYSA-N
MW286.30 g/mol
LogP2.96
Rot. Bonds4

About N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide

N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide (PubChem CID 62815906) has the molecular formula C14H17F3N2O and a molecular weight of 286.30 g/mol. Its IUPAC name is N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide
PubChem CID62815906
Molecular FormulaC14H17F3N2O
Molecular Weight286.30 g/mol
Exact Mass286.13
IUPAC NameN-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide
SMILESO=C(CNc1cc(F)c(F)cc1F)NC1CCCCC1
InChIInChI=1S/C14H17F3N2O/c15-10-6-12(17)13(7-11(10)16)18-8-14(20)19-9-4-2-1-3-5-9/h6-7,9,18H,1-5,8H2,(H,19,20)
InChIKeyNWXZBOVOEQFYDT-UHFFFAOYSA-N
XLogP2.96
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.30
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

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Related Compounds

N-cyclopentyl-2-(2,4-difluoroanilino)acetamide
CID 28582841
2-(4-bromo-2-fluoroanilino)-N-cyclopentylacetamide
CID 28574766
N-cycloheptyl-2-(3,4,5-trifluoroanilino)acetamide
CID 62810286
N-cyclopropyl-2-(2,5-difluoroanilino)acetamide
CID 28574514
N-cyclohexyl-2-(2,6-difluoroanilino)acetamide
CID 28879040
N-cyclopentyl-2-(2,6-difluoroanilino)acetamide
CID 28879037
N-cyclopentyl-2-(2,4-dichloroanilino)acetamide
CID 28572342
2-(2-chloro-4,6-difluoroanilino)-N-cyclohexylacetamide
CID 82889686
N-cyclohexyl-2-(2-iodoanilino)acetamide
CID 28878262
N-cyclopentyl-2-(3-fluoro-4-methylanilino)acetamide
CID 28583319
2-(2-bromo-4-chloroanilino)-N-cyclopentylacetamide
CID 81270445
N-cyclohexyl-2-(2,5-dichloro-4-methylanilino)acetamide
CID 104726780

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide?
The IUPAC name of N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide (CID 62815906) is N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide?
The canonical SMILES for N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide is O=C(CNc1cc(F)c(F)cc1F)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide?
The InChIKey is NWXZBOVOEQFYDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17F3N2O/c15-10-6-12(17)13(7-11(10)16)18-8-14(20)19-9-4-2-1-3-5-9/h6-7,9,18H,1-5,8H2,(H,19,20).
What are the key properties of N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide?
N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide has a molecular weight of 286.30 g/mol, XLogP of 2.96, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(2,4,5-trifluoroanilino)acetamide is sourced from PubChem (CID 62815906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).