2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide

C20H18N2O3 — CID 2318546

IUPAC2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide
SMILESCc1ccc(Oc2ccc(OCC(=O)Nc3ccncc3)cc2)cc1
InChIInChI=1S/C20H18N2O3/c1-15-2-4-18(5-3-15)25-19-8-6-17(7-9-19)24-14-20(23)22-16-10-12-21-13-11-16/h2-13H,14H2,1H3,(H,21,22,23)
InChIKeyCORMWJFTMXSPFO-UHFFFAOYSA-N
MW334.38 g/mol
LogP4.20
Rot. Bonds6

About 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide

2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide (PubChem CID 2318546) has the molecular formula C20H18N2O3 and a molecular weight of 334.38 g/mol. Its IUPAC name is 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide.

Molecular Properties

Compound Name2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide
PubChem CID2318546
Molecular FormulaC20H18N2O3
Molecular Weight334.38 g/mol
Exact Mass334.13
IUPAC Name2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide
SMILESCc1ccc(Oc2ccc(OCC(=O)Nc3ccncc3)cc2)cc1
InChIInChI=1S/C20H18N2O3/c1-15-2-4-18(5-3-15)25-19-8-6-17(7-9-19)24-14-20(23)22-16-10-12-21-13-11-16/h2-13H,14H2,1H3,(H,21,22,23)
InChIKeyCORMWJFTMXSPFO-UHFFFAOYSA-N
XLogP4.20
TPSA60.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-[(4-ethylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-2-(4-pyridin-3-ylphenoxy)acetamide
CID 76071870
N-Pyridin-4-yl-2-p-tolyloxy-acetamide
CID 572152
2-[3-(3-methylbutoxy)phenoxy]-N-pyridin-4-ylacetamide
CID 2323706
2-(2-methylphenoxy)-N-(3-pyridinylmethyl)propanamide
CID 2977532
1-(4-methoxybenzyl)-N-[4-(3-pyridinyloxy)phenyl]-4-piperidinecarboxamide
CID 24790246
N-(4-(benzyloxy)phenethyl)pyridin-4-amine
CID 44292136
N-isoquinolin-6-yl-2-(2-methylphenoxy)acetamide
CID 138115404
2-(3-methylphenoxy)-N-(4-pyridinyl)acetamide
CID 814788
2-(2-Methoxy-phenoxy)-N-pyridin-4-yl-acetamide
CID 748753
2-(4-Isopropyl-phenoxy)-N-pyridin-4-yl-acetamide
CID 798146
2-(2,5-dimethylphenoxy)-N-(pyridin-4-yl)acetamide
CID 807261
2-naphthalen-2-yloxy-N-pyridin-4-ylacetamide
CID 823638

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide?
The IUPAC name of 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide (CID 2318546) is 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide.
What is the SMILES notation for 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide?
The canonical SMILES for 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide is Cc1ccc(Oc2ccc(OCC(=O)Nc3ccncc3)cc2)cc1.
What is the InChIKey of 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide?
The InChIKey is CORMWJFTMXSPFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3/c1-15-2-4-18(5-3-15)25-19-8-6-17(7-9-19)24-14-20(23)22-16-10-12-21-13-11-16/h2-13H,14H2,1H3,(H,21,22,23).
What are the key properties of 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide?
2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide has a molecular weight of 334.38 g/mol, XLogP of 4.20, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-methylphenoxy)phenoxy]-N-pyridin-4-ylacetamide is sourced from PubChem (CID 2318546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).