N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide

C21H20N2O3 — CID 11653141

IUPACN-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
SMILESCC(=O)N(Cc1ccccc1O[11CH3])c1cnccc1Oc1ccccc1
InChIInChI=1S/C21H20N2O3/c1-16(24)23(15-17-8-6-7-11-20(17)25-2)19-14-22-13-12-21(19)26-18-9-4-3-5-10-18/h3-14H,15H2,1-2H3/i2-1
InChIKeyDHZBNHMEIOBPAE-JVVVGQRLSA-N
MW347.40 g/mol
LogP4.44
Rot. Bonds6

About N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide

N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide (PubChem CID 11653141) has the molecular formula C21H20N2O3 and a molecular weight of 347.40 g/mol. Its IUPAC name is N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
PubChem CID11653141
Molecular FormulaC21H20N2O3
Molecular Weight347.40 g/mol
Exact Mass347.16
IUPAC NameN-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
SMILESCC(=O)N(Cc1ccccc1O[11CH3])c1cnccc1Oc1ccccc1
InChIInChI=1S/C21H20N2O3/c1-16(24)23(15-17-8-6-7-11-20(17)25-2)19-14-22-13-12-21(19)26-18-9-4-3-5-10-18/h3-14H,15H2,1-2H3/i2-1
InChIKeyDHZBNHMEIOBPAE-JVVVGQRLSA-N
XLogP4.44
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.40
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The IUPAC name of N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide (CID 11653141) is N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide.
What is the SMILES notation for N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The canonical SMILES for N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide is CC(=O)N(Cc1ccccc1O[11CH3])c1cnccc1Oc1ccccc1.
What is the InChIKey of N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The InChIKey is DHZBNHMEIOBPAE-JVVVGQRLSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-16(24)23(15-17-8-6-7-11-20(17)25-2)19-14-22-13-12-21(19)26-18-9-4-3-5-10-18/h3-14H,15H2,1-2H3/i2-1.
What are the key properties of N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide has a molecular weight of 347.40 g/mol, XLogP of 4.44, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-(111C)methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 11653141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).