2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide

C17H19FN2O2 — CID 54811098

IUPAC2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O2/c1-2-11-22-16-9-7-15(8-10-16)20-17(21)12-19-14-5-3-13(18)4-6-14/h3-10,19H,2,11-12H2,1H3,(H,20,21)
InChIKeyKPYWMAVPCFCFNP-UHFFFAOYSA-N
MW302.35 g/mol
LogP3.67
Rot. Bonds7

About 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide

2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide (PubChem CID 54811098) has the molecular formula C17H19FN2O2 and a molecular weight of 302.35 g/mol. Its IUPAC name is 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide
PubChem CID54811098
Molecular FormulaC17H19FN2O2
Molecular Weight302.35 g/mol
Exact Mass302.14
IUPAC Name2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide
SMILESCCCOc1ccc(NC(=O)CNc2ccc(F)cc2)cc1
InChIInChI=1S/C17H19FN2O2/c1-2-11-22-16-9-7-15(8-10-16)20-17(21)12-19-14-5-3-13(18)4-6-14/h3-10,19H,2,11-12H2,1H3,(H,20,21)
InChIKeyKPYWMAVPCFCFNP-UHFFFAOYSA-N
XLogP3.67
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-propoxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54820383
N-[4-(3-methylbutoxy)phenyl]-2-(4-propoxyanilino)acetamide
CID 54820417
N-[4-[[2-(4-butoxyanilino)-2-oxoethyl]amino]phenyl]propanamide
CID 54835555
N-[4-[[2-(4-butoxyanilino)acetyl]amino]phenyl]butanamide
CID 54820523
2-(4-butoxyanilino)-N-(3-propoxyphenyl)acetamide
CID 54820125
2-(3-propan-2-yloxyanilino)-N-(4-propoxyphenyl)acetamide
CID 54830279
N-[4-[[2-(4-fluoroanilino)-2-oxoethyl]amino]phenyl]butanamide
CID 54836956
2-(methylamino)-N-(4-propoxyphenyl)acetamide
CID 54820943
N,N-diethyl-4-[[2-oxo-2-(4-propoxyanilino)ethyl]amino]benzamide
CID 54834104
N-[4-[[2-(4-fluoroanilino)acetyl]amino]phenyl]propanamide
CID 54813242
2-(4-butoxyphenoxy)-N-(4-fluorophenyl)acetamide
CID 4732741
N-(3-acetamidophenyl)-2-(4-propoxyanilino)acetamide
CID 54822822

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide?
The IUPAC name of 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide (CID 54811098) is 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide?
The canonical SMILES for 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide is CCCOc1ccc(NC(=O)CNc2ccc(F)cc2)cc1.
What is the InChIKey of 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide?
The InChIKey is KPYWMAVPCFCFNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O2/c1-2-11-22-16-9-7-15(8-10-16)20-17(21)12-19-14-5-3-13(18)4-6-14/h3-10,19H,2,11-12H2,1H3,(H,20,21).
What are the key properties of 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide?
2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide has a molecular weight of 302.35 g/mol, XLogP of 3.67, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoroanilino)-N-(4-propoxyphenyl)acetamide is sourced from PubChem (CID 54811098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).