N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide

C14H16N4O3 — CID 63205929

IUPACN-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide
SMILESCOc1ccc(N)cc1NC(=O)Cn1cc(C)cnc1=O
InChIInChI=1S/C14H16N4O3/c1-9-6-16-14(20)18(7-9)8-13(19)17-11-5-10(15)3-4-12(11)21-2/h3-7H,8,15H2,1-2H3,(H,17,19)
InChIKeyCQNHKXPZOGWLTJ-UHFFFAOYSA-N
MW288.31 g/mol
LogP0.78
Rot. Bonds4

About N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide

N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide (PubChem CID 63205929) has the molecular formula C14H16N4O3 and a molecular weight of 288.31 g/mol. Its IUPAC name is N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide
PubChem CID63205929
Molecular FormulaC14H16N4O3
Molecular Weight288.31 g/mol
Exact Mass288.12
IUPAC NameN-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide
SMILESCOc1ccc(N)cc1NC(=O)Cn1cc(C)cnc1=O
InChIInChI=1S/C14H16N4O3/c1-9-6-16-14(20)18(7-9)8-13(19)17-11-5-10(15)3-4-12(11)21-2/h3-7H,8,15H2,1-2H3,(H,17,19)
InChIKeyCQNHKXPZOGWLTJ-UHFFFAOYSA-N
XLogP0.78
TPSA99.24 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.31
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

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2-(2-amino-4-methyl-6-oxopyrimidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
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N-(5-amino-2-methoxyphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]acetamide
CID 60876752
N-(5-amino-2-methoxyphenyl)-2-(2,5-dimethylpyrazol-3-yl)sulfanylacetamide
CID 62410099
N-(5-amino-2-methoxyphenyl)-2-(1,3-thiazol-2-ylsulfanyl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide?
The IUPAC name of N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide (CID 63205929) is N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide.
What is the SMILES notation for N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide?
The canonical SMILES for N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide is COc1ccc(N)cc1NC(=O)Cn1cc(C)cnc1=O.
What is the InChIKey of N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide?
The InChIKey is CQNHKXPZOGWLTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O3/c1-9-6-16-14(20)18(7-9)8-13(19)17-11-5-10(15)3-4-12(11)21-2/h3-7H,8,15H2,1-2H3,(H,17,19).
What are the key properties of N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide?
N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide has a molecular weight of 288.31 g/mol, XLogP of 0.78, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-methoxyphenyl)-2-(5-methyl-2-oxopyrimidin-1-yl)acetamide is sourced from PubChem (CID 63205929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).