2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide

C18H19FN2O3 — CID 46222705

IUPAC2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide
SMILESCC(=O)NCC(=O)NCc1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C18H19FN2O3/c1-13(22)20-11-18(23)21-10-14-5-7-17(8-6-14)24-12-15-3-2-4-16(19)9-15/h2-9H,10-12H2,1H3,(H,20,22)(H,21,23)
InChIKeyKPMLXOJIMSFWPQ-UHFFFAOYSA-N
MW330.36 g/mol
LogP2.16
Rot. Bonds7

About 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide

2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide (PubChem CID 46222705) has the molecular formula C18H19FN2O3 and a molecular weight of 330.36 g/mol. Its IUPAC name is 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide
PubChem CID46222705
Molecular FormulaC18H19FN2O3
Molecular Weight330.36 g/mol
Exact Mass330.14
IUPAC Name2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide
SMILESCC(=O)NCC(=O)NCc1ccc(OCc2cccc(F)c2)cc1
InChIInChI=1S/C18H19FN2O3/c1-13(22)20-11-18(23)21-10-14-5-7-17(8-6-14)24-12-15-3-2-4-16(19)9-15/h2-9H,10-12H2,1H3,(H,20,22)(H,21,23)
InChIKeyKPMLXOJIMSFWPQ-UHFFFAOYSA-N
XLogP2.16
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.36
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-2,2-dimethylpropanamide
CID 37469359
4-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]butanamide
CID 119283185
tert-butyl N-[3-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]-3-oxopropyl]carbamate
CID 38525612
N-tert-butyl-2-[[N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-N'-methylcarbamimidoyl]amino]acetamide
CID 111385412
2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-3-methoxypropanamide;hydrochloride
CID 120985182
(2S)-2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide
CID 153327338
2-amino-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pentanamide;hydrochloride
CID 119283180
3-fluoro-N-[2-oxo-2-[[4-(2,2,2-trifluoroethoxy)phenyl]methylamino]ethyl]benzamide
CID 30293608
2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]-2-(1,3-thiazol-2-yl)acetamide
CID 58115516
2-(8-azabicyclo[3.2.1]octan-3-yl)-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide;hydrochloride
CID 119712202
(2S)-2-[[4-[(3-fluorophenyl)methoxy]phenyl]methylamino]-N-methylpropanamide
CID 10193260
2-chloro-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]pyridine-4-carboxamide
CID 38526114

Frequently Asked Questions

What is the IUPAC name of 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide?
The IUPAC name of 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide (CID 46222705) is 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide.
What is the SMILES notation for 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide?
The canonical SMILES for 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide is CC(=O)NCC(=O)NCc1ccc(OCc2cccc(F)c2)cc1.
What is the InChIKey of 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide?
The InChIKey is KPMLXOJIMSFWPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FN2O3/c1-13(22)20-11-18(23)21-10-14-5-7-17(8-6-14)24-12-15-3-2-4-16(19)9-15/h2-9H,10-12H2,1H3,(H,20,22)(H,21,23).
What are the key properties of 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide?
2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide has a molecular weight of 330.36 g/mol, XLogP of 2.16, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-acetamido-N-[[4-[(3-fluorophenyl)methoxy]phenyl]methyl]acetamide is sourced from PubChem (CID 46222705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).