N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide

C19H22FN3O3 — CID 8797411

IUPACN-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide
SMILESCN(CCOc1ccccc1)CC(=O)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H22FN3O3/c1-23(11-12-26-17-5-3-2-4-6-17)14-19(25)21-13-18(24)22-16-9-7-15(20)8-10-16/h2-10H,11-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyZKPFZDCWCVJCIK-UHFFFAOYSA-N
MW359.40 g/mol
LogP1.89
Rot. Bonds9

About N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide

N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide (PubChem CID 8797411) has the molecular formula C19H22FN3O3 and a molecular weight of 359.40 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide
PubChem CID8797411
Molecular FormulaC19H22FN3O3
Molecular Weight359.40 g/mol
Exact Mass359.16
IUPAC NameN-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide
SMILESCN(CCOc1ccccc1)CC(=O)NCC(=O)Nc1ccc(F)cc1
InChIInChI=1S/C19H22FN3O3/c1-23(11-12-26-17-5-3-2-4-6-17)14-19(25)21-13-18(24)22-16-9-7-15(20)8-10-16/h2-10H,11-14H2,1H3,(H,21,25)(H,22,24)
InChIKeyZKPFZDCWCVJCIK-UHFFFAOYSA-N
XLogP1.89
TPSA70.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.40
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide (CID 8797411) is N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide is CN(CCOc1ccccc1)CC(=O)NCC(=O)Nc1ccc(F)cc1.
What is the InChIKey of N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide?
The InChIKey is ZKPFZDCWCVJCIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22FN3O3/c1-23(11-12-26-17-5-3-2-4-6-17)14-19(25)21-13-18(24)22-16-9-7-15(20)8-10-16/h2-10H,11-14H2,1H3,(H,21,25)(H,22,24).
What are the key properties of N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide?
N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide has a molecular weight of 359.40 g/mol, XLogP of 1.89, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-[[2-[methyl(2-phenoxyethyl)amino]acetyl]amino]acetamide is sourced from PubChem (CID 8797411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).