N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide

C17H22N4O3 — CID 122356242

IUPACN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2c(C)nc(N(C)C)nc2C)c1
InChIInChI=1S/C17H22N4O3/c1-11-16(12(2)19-17(18-11)21(3)4)20-15(22)10-24-14-8-6-7-13(9-14)23-5/h6-9H,10H2,1-5H3,(H,20,22)
InChIKeyMAHBBPAMBWBPNF-UHFFFAOYSA-N
MW330.39 g/mol
LogP2.19
Rot. Bonds6

About N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide

N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide (PubChem CID 122356242) has the molecular formula C17H22N4O3 and a molecular weight of 330.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide
PubChem CID122356242
Molecular FormulaC17H22N4O3
Molecular Weight330.39 g/mol
Exact Mass330.17
IUPAC NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide
SMILESCOc1cccc(OCC(=O)Nc2c(C)nc(N(C)C)nc2C)c1
InChIInChI=1S/C17H22N4O3/c1-11-16(12(2)19-17(18-11)21(3)4)20-15(22)10-24-14-8-6-7-13(9-14)23-5/h6-9H,10H2,1-5H3,(H,20,22)
InChIKeyMAHBBPAMBWBPNF-UHFFFAOYSA-N
XLogP2.19
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[3-[2-(4-methoxyanilino)-2-oxoethoxy]phenoxy]-N-(4-methoxyphenyl)acetamide
CID 71417144
2-(3-methoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 19204025
N-[4-(dimethylamino)-2-methoxypyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide
CID 122319402
2-(3-methoxyphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)acetamide
CID 19203579
2-(3-methoxyphenoxy)-N-propan-2-ylacetamide
CID 4149029
2-(3-ethoxyphenoxy)-N-(3-methoxyphenyl)acetamide
CID 112977809
N-(2,5-dimethoxyphenyl)-2-(3-methoxyphenoxy)acetamide
CID 19204029
2-(3-methoxyphenoxy)-N-[2-(2,4,5-trimethylimidazol-1-yl)pyrimidin-5-yl]acetamide
CID 122301312
2-(4-methoxyphenoxy)-N-(6-methyl-2-pyridinyl)acetamide
CID 3146339
N-(3-amino-4-methylphenyl)-2-(3-methoxyphenoxy)acetamide
CID 28867332
N-[2-[[6-(dimethylamino)-2-methylpyrimidin-4-yl]amino]ethyl]-2-(3-methoxyphenoxy)acetamide
CID 122293596
2-(4-chlorophenoxy)-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)acetamide
CID 91969137

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide?
The IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide (CID 122356242) is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide is COc1cccc(OCC(=O)Nc2c(C)nc(N(C)C)nc2C)c1.
What is the InChIKey of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide?
The InChIKey is MAHBBPAMBWBPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O3/c1-11-16(12(2)19-17(18-11)21(3)4)20-15(22)10-24-14-8-6-7-13(9-14)23-5/h6-9H,10H2,1-5H3,(H,20,22).
What are the key properties of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide?
N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide has a molecular weight of 330.39 g/mol, XLogP of 2.19, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(3-methoxyphenoxy)acetamide is sourced from PubChem (CID 122356242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).