2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide

C19H21N3O3 — CID 82252786

IUPAC2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide
SMILESCOc1cccc(C2=NCCCN2)c1OCC(=O)Nc1ccccc1
InChIInChI=1S/C19H21N3O3/c1-24-16-10-5-9-15(19-20-11-6-12-21-19)18(16)25-13-17(23)22-14-7-3-2-4-8-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21)(H,22,23)
InChIKeyJXBQOWYGIMXTBZ-UHFFFAOYSA-N
MW339.40 g/mol
LogP2.45
Rot. Bonds6

About 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide

2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide (PubChem CID 82252786) has the molecular formula C19H21N3O3 and a molecular weight of 339.40 g/mol. Its IUPAC name is 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide.

Molecular Properties

Compound Name2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide
PubChem CID82252786
Molecular FormulaC19H21N3O3
Molecular Weight339.40 g/mol
Exact Mass339.16
IUPAC Name2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide
SMILESCOc1cccc(C2=NCCCN2)c1OCC(=O)Nc1ccccc1
InChIInChI=1S/C19H21N3O3/c1-24-16-10-5-9-15(19-20-11-6-12-21-19)18(16)25-13-17(23)22-14-7-3-2-4-8-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21)(H,22,23)
InChIKeyJXBQOWYGIMXTBZ-UHFFFAOYSA-N
XLogP2.45
TPSA71.95 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.40
LogP ≤ 52.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-[(2-chloro-6-fluorophenyl)methoxy]-3-methoxyphenyl]-1,4,5,6-tetrahydropyrimidine
CID 82252897
2-(2,6-dimethoxyphenoxy)-N-(4-phenylmethoxyphenyl)acetamide
CID 7612423
2-(2,6-dimethoxyphenoxy)-N-(3-fluorophenyl)acetamide
CID 7612567
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 9078575
2-[2-(hydroxymethyl)-6-methoxyphenoxy]-N-(4-methylphenyl)acetamide
CID 45371710
N-[4-(N-ethylanilino)phenyl]-2-(2-methoxyphenoxy)acetamide
CID 112986562
2-(2-methoxyphenoxy)-N-[6-(3-methylanilino)pyridazin-3-yl]acetamide
CID 113045737
2-(2,6-dimethylphenoxy)-N-[5-(2-methoxyphenyl)-1H-1,2,4-triazol-3-yl]acetamide
CID 55646062
2-[2-[(E)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]-6-methoxyphenoxy]-N-phenylacetamide
CID 1003555
2-(2-methoxyphenoxy)-N-[4-[(2-methoxyphenyl)methylamino]phenyl]acetamide
CID 112982660
2-(2-naphthalen-1-ylquinazolin-4-yl)oxy-N-phenylacetamide
CID 14894058

Frequently Asked Questions

What is the IUPAC name of 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide?
The IUPAC name of 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide (CID 82252786) is 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide.
What is the SMILES notation for 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide?
The canonical SMILES for 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide is COc1cccc(C2=NCCCN2)c1OCC(=O)Nc1ccccc1.
What is the InChIKey of 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide?
The InChIKey is JXBQOWYGIMXTBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3/c1-24-16-10-5-9-15(19-20-11-6-12-21-19)18(16)25-13-17(23)22-14-7-3-2-4-8-14/h2-5,7-10H,6,11-13H2,1H3,(H,20,21)(H,22,23).
What are the key properties of 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide?
2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide has a molecular weight of 339.40 g/mol, XLogP of 2.45, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-methoxy-6-(1,4,5,6-tetrahydropyrimidin-2-yl)phenoxy]-N-phenylacetamide is sourced from PubChem (CID 82252786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).