N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide

C17H25FN2O2 — CID 42765956

IUPACN-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide
SMILESCCCCCCCCC(=O)NCC(=O)Nc1ccccc1F
InChIInChI=1S/C17H25FN2O2/c1-2-3-4-5-6-7-12-16(21)19-13-17(22)20-15-11-9-8-10-14(15)18/h8-11H,2-7,12-13H2,1H3,(H,19,21)(H,20,22)
InChIKeyIUNVFMNHEIXADX-UHFFFAOYSA-N
MW308.40 g/mol
LogP3.63
Rot. Bonds10

About N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide

N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide (PubChem CID 42765956) has the molecular formula C17H25FN2O2 and a molecular weight of 308.40 g/mol. Its IUPAC name is N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide.

Molecular Properties

Compound NameN-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide
PubChem CID42765956
Molecular FormulaC17H25FN2O2
Molecular Weight308.40 g/mol
Exact Mass308.19
IUPAC NameN-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide
SMILESCCCCCCCCC(=O)NCC(=O)Nc1ccccc1F
InChIInChI=1S/C17H25FN2O2/c1-2-3-4-5-6-7-12-16(21)19-13-17(22)20-15-11-9-8-10-14(15)18/h8-11H,2-7,12-13H2,1H3,(H,19,21)(H,20,22)
InChIKeyIUNVFMNHEIXADX-UHFFFAOYSA-N
XLogP3.63
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.40
LogP ≤ 53.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(2-fluoroanilino)-2-oxoethyl]pentanamide
CID 42765949
N-(2-fluorophenyl)hexanamide
CID 3481165
N-(2-fluorophenyl)-2-(octylamino)acetamide
CID 78914339
2-(butylcarbamoylamino)-N-(2-fluorophenyl)acetamide
CID 3386370
ethyl 4-[[2-(2-fluoroanilino)-2-oxoethyl]amino]-4-oxobutanoate
CID 4261484
N-[3-[[2-(2-fluoroanilino)-2-oxoethyl]amino]phenyl]hexanamide
CID 54842530
N-[2-(2-bromoanilino)-2-oxoethyl]pentanamide
CID 18112658
N-(2-fluorophenyl)butanamide
CID 849021
(2S)-2-ethyl-N-[2-(2-fluoroanilino)-2-oxoethyl]hexanamide
CID 7356542
N-(2-aminophenyl)octadecanamide
CID 68839220
N-(2-fluorophenyl)-5-hydroxypentanamide
CID 79019059
2-[(2-ethylphenyl)carbamoylamino]-N-(2-fluorophenyl)acetamide
CID 772197

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide?
The IUPAC name of N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide (CID 42765956) is N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide.
What is the SMILES notation for N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide?
The canonical SMILES for N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide is CCCCCCCCC(=O)NCC(=O)Nc1ccccc1F.
What is the InChIKey of N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide?
The InChIKey is IUNVFMNHEIXADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O2/c1-2-3-4-5-6-7-12-16(21)19-13-17(22)20-15-11-9-8-10-14(15)18/h8-11H,2-7,12-13H2,1H3,(H,19,21)(H,20,22).
What are the key properties of N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide?
N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide has a molecular weight of 308.40 g/mol, XLogP of 3.63, 10 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluoroanilino)-2-oxoethyl]nonanamide is sourced from PubChem (CID 42765956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).