N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide

C12H12N4O2 — CID 79917590

IUPACN-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide
SMILESCC(=O)Nc1ccccc1Oc1ncncc1N
InChIInChI=1S/C12H12N4O2/c1-8(17)16-10-4-2-3-5-11(10)18-12-9(13)6-14-7-15-12/h2-7H,13H2,1H3,(H,16,17)
InChIKeyBVEBHIJNFSNHAN-UHFFFAOYSA-N
MW244.25 g/mol
LogP1.81
Rot. Bonds3

About N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide

N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide (PubChem CID 79917590) has the molecular formula C12H12N4O2 and a molecular weight of 244.25 g/mol. Its IUPAC name is N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide.

Molecular Properties

Compound NameN-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide
PubChem CID79917590
Molecular FormulaC12H12N4O2
Molecular Weight244.25 g/mol
Exact Mass244.10
IUPAC NameN-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide
SMILESCC(=O)Nc1ccccc1Oc1ncncc1N
InChIInChI=1S/C12H12N4O2/c1-8(17)16-10-4-2-3-5-11(10)18-12-9(13)6-14-7-15-12/h2-7H,13H2,1H3,(H,16,17)
InChIKeyBVEBHIJNFSNHAN-UHFFFAOYSA-N
XLogP1.81
TPSA90.13 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-(5-iodopyrimidin-4-yl)oxyphenyl]acetamide
CID 66320025
N-[2-(2-amino-5-bromopyrimidin-4-yl)oxyphenyl]acetamide
CID 80882186
N-[2-[(5-amino-4-methyl-2-pyridinyl)oxy]phenyl]acetamide
CID 79175977
6-(2-acetamidophenoxy)-5-aminopyridine-2-carboxylic acid
CID 114408530
N-[2-[[5-(aminomethyl)-2-pyridinyl]oxy]phenyl]acetamide
CID 16789726
4-(2-fluoro-3-methylphenoxy)pyrimidin-5-amine
CID 107655411
N-[2-[(3-sulfamoyl-2-pyridinyl)oxy]phenyl]acetamide
CID 115928437
2-(2-acetamidophenoxy)-4-methylpyrimidine-5-carboxylic acid
CID 83178889
(2-acetamidophenyl) hypochlorite
CID 150463309
N-[2-(6-amino-2-ethyl-5-methylpyrimidin-4-yl)oxyphenyl]acetamide
CID 80987961
N-[2-[2-(2-aminophenyl)ethoxy]phenyl]acetamide
CID 62496426
N-[2-[(2-chloro-5-methyl-4-pyridinyl)oxy]phenyl]acetamide
CID 83268145

Frequently Asked Questions

What is the IUPAC name of N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide?
The IUPAC name of N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide (CID 79917590) is N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide.
What is the SMILES notation for N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide?
The canonical SMILES for N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide is CC(=O)Nc1ccccc1Oc1ncncc1N.
What is the InChIKey of N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide?
The InChIKey is BVEBHIJNFSNHAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N4O2/c1-8(17)16-10-4-2-3-5-11(10)18-12-9(13)6-14-7-15-12/h2-7H,13H2,1H3,(H,16,17).
What are the key properties of N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide?
N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide has a molecular weight of 244.25 g/mol, XLogP of 1.81, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(5-aminopyrimidin-4-yl)oxyphenyl]acetamide is sourced from PubChem (CID 79917590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).