N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide

C21H20FN3O2 — CID 113012140

IUPACN-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C21H20FN3O2/c1-15-2-9-19(10-3-15)27-14-21(26)25-18-8-11-20(24-13-18)23-12-16-4-6-17(22)7-5-16/h2-11,13H,12,14H2,1H3,(H,23,24)(H,25,26)
InChIKeyUEPIKLMMYSMDNV-UHFFFAOYSA-N
MW365.41 g/mol
LogP4.16
Rot. Bonds7

About N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide

N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide (PubChem CID 113012140) has the molecular formula C21H20FN3O2 and a molecular weight of 365.41 g/mol. Its IUPAC name is N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide
PubChem CID113012140
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC NameN-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide
SMILESCc1ccc(OCC(=O)Nc2ccc(NCc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C21H20FN3O2/c1-15-2-9-19(10-3-15)27-14-21(26)25-18-8-11-20(24-13-18)23-12-16-4-6-17(22)7-5-16/h2-11,13H,12,14H2,1H3,(H,23,24)(H,25,26)
InChIKeyUEPIKLMMYSMDNV-UHFFFAOYSA-N
XLogP4.16
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 54.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methylphenoxy)-N-[6-[(2-methylphenyl)methylamino]-3-pyridinyl]acetamide
CID 113011587
4-fluoro-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011762
N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-4-methylbenzamide
CID 113012110
2-(4-methylphenoxy)-N-[4-[(4-methylphenyl)methylamino]phenyl]acetamide
CID 112982175
N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]butanamide
CID 113011745
N-(4-methylphenyl)-2-[4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
CID 66539248
N-[5-[2-(4-chlorophenyl)ethylamino]-2-pyridinyl]-2-(4-methylphenoxy)acetamide
CID 113029025
4-methyl-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011759
2-fluoro-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]benzamide
CID 113011760
2-methyl-N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]propanamide
CID 113011746
2-(4-methylphenoxy)-N-(4-methylphenyl)acetamide
CID 681889
N-(4-ethylphenyl)-2-(4-fluorophenoxy)acetamide
CID 893586

Frequently Asked Questions

What is the IUPAC name of N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The IUPAC name of N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide (CID 113012140) is N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide.
What is the SMILES notation for N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The canonical SMILES for N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide is Cc1ccc(OCC(=O)Nc2ccc(NCc3ccc(F)cc3)nc2)cc1.
What is the InChIKey of N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
The InChIKey is UEPIKLMMYSMDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O2/c1-15-2-9-19(10-3-15)27-14-21(26)25-18-8-11-20(24-13-18)23-12-16-4-6-17(22)7-5-16/h2-11,13H,12,14H2,1H3,(H,23,24)(H,25,26).
What are the key properties of N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide?
N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide has a molecular weight of 365.41 g/mol, XLogP of 4.16, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[(4-fluorophenyl)methylamino]-3-pyridinyl]-2-(4-methylphenoxy)acetamide is sourced from PubChem (CID 113012140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).