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

C21H20N2O3 — CID 70684659

IUPACN-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
SMILESCOc1cccc(CN(C(C)=O)c2cnccc2Oc2ccccc2)c1
InChIInChI=1S/C21H20N2O3/c1-16(24)23(15-17-7-6-10-19(13-17)25-2)20-14-22-12-11-21(20)26-18-8-4-3-5-9-18/h3-14H,15H2,1-2H3
InChIKeyFNFYTXRBOQGQBF-UHFFFAOYSA-N
MW348.40 g/mol
LogP4.44
Rot. Bonds6

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

N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide (PubChem CID 70684659) has the molecular formula C21H20N2O3 and a molecular weight of 348.40 g/mol. Its IUPAC name is N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound NameN-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
PubChem CID70684659
Molecular FormulaC21H20N2O3
Molecular Weight348.40 g/mol
Exact Mass348.15
IUPAC NameN-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide
SMILESCOc1cccc(CN(C(C)=O)c2cnccc2Oc2ccccc2)c1
InChIInChI=1S/C21H20N2O3/c1-16(24)23(15-17-7-6-10-19(13-17)25-2)20-14-22-12-11-21(20)26-18-8-4-3-5-9-18/h3-14H,15H2,1-2H3
InChIKeyFNFYTXRBOQGQBF-UHFFFAOYSA-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 ≤ 500348.40
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-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The IUPAC name of N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide (CID 70684659) is N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide.
What is the SMILES notation for N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The canonical SMILES for N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide is COc1cccc(CN(C(C)=O)c2cnccc2Oc2ccccc2)c1.
What is the InChIKey of N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
The InChIKey is FNFYTXRBOQGQBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N2O3/c1-16(24)23(15-17-7-6-10-19(13-17)25-2)20-14-22-12-11-21(20)26-18-8-4-3-5-9-18/h3-14H,15H2,1-2H3.
What are the key properties of N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide?
N-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide has a molecular weight of 348.40 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-[(3-methoxyphenyl)methyl]-N-(4-phenoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 70684659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).