N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide

C22H21FN2O3 — CID 58029262

IUPACN-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide
SMILESCC(=O)N(Cc1ccccc1OCCF)c1cccnc1Oc1ccccc1
InChIInChI=1S/C22H21FN2O3/c1-17(26)25(16-18-8-5-6-12-21(18)27-15-13-23)20-11-7-14-24-22(20)28-19-9-3-2-4-10-19/h2-12,14H,13,15-16H2,1H3
InChIKeyXWIVZJUXMCAIQT-UHFFFAOYSA-N
MW380.42 g/mol
LogP4.78
Rot. Bonds8

About N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide

N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide (PubChem CID 58029262) has the molecular formula C22H21FN2O3 and a molecular weight of 380.42 g/mol. Its IUPAC name is N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide
PubChem CID58029262
Molecular FormulaC22H21FN2O3
Molecular Weight380.42 g/mol
Exact Mass380.15
IUPAC NameN-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide
SMILESCC(=O)N(Cc1ccccc1OCCF)c1cccnc1Oc1ccccc1
InChIInChI=1S/C22H21FN2O3/c1-17(26)25(16-18-8-5-6-12-21(18)27-15-13-23)20-11-7-14-24-22(20)28-19-9-3-2-4-10-19/h2-12,14H,13,15-16H2,1H3
InChIKeyXWIVZJUXMCAIQT-UHFFFAOYSA-N
XLogP4.78
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.42
LogP ≤ 54.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide?
The IUPAC name of N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide (CID 58029262) is N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide.
What is the SMILES notation for N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide?
The canonical SMILES for N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide is CC(=O)N(Cc1ccccc1OCCF)c1cccnc1Oc1ccccc1.
What is the InChIKey of N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide?
The InChIKey is XWIVZJUXMCAIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21FN2O3/c1-17(26)25(16-18-8-5-6-12-21(18)27-15-13-23)20-11-7-14-24-22(20)28-19-9-3-2-4-10-19/h2-12,14H,13,15-16H2,1H3.
What are the key properties of N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide?
N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide has a molecular weight of 380.42 g/mol, XLogP of 4.78, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-fluoroethoxy)phenyl]methyl]-N-(2-phenoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 58029262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).