N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide

C18H17N3O3 — CID 122304049

IUPACN-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide
SMILESCOc1ncc(NC(=O)Cc2cccc3ccccc23)c(OC)n1
InChIInChI=1S/C18H17N3O3/c1-23-17-15(11-19-18(21-17)24-2)20-16(22)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyVYUQBDOMNZLOOU-UHFFFAOYSA-N
MW323.35 g/mol
LogP2.83
Rot. Bonds5

About N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide

N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide (PubChem CID 122304049) has the molecular formula C18H17N3O3 and a molecular weight of 323.35 g/mol. Its IUPAC name is N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide.

Molecular Properties

Compound NameN-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide
PubChem CID122304049
Molecular FormulaC18H17N3O3
Molecular Weight323.35 g/mol
Exact Mass323.13
IUPAC NameN-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide
SMILESCOc1ncc(NC(=O)Cc2cccc3ccccc23)c(OC)n1
InChIInChI=1S/C18H17N3O3/c1-23-17-15(11-19-18(21-17)24-2)20-16(22)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H,20,22)
InChIKeyVYUQBDOMNZLOOU-UHFFFAOYSA-N
XLogP2.83
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.35
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,4-diethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide
CID 122304411
N-(2-ethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228282
N-(2,4-dimethoxypyrimidin-5-yl)-2,6-difluorobenzamide
CID 71807571
methyl 4-[(2-naphthalen-1-ylacetyl)amino]-1H-pyrazole-5-carboxylate
CID 52941226
N-[4-(dimethylamino)-2-methoxypyrimidin-5-yl]-2-(2-fluorophenyl)acetamide
CID 122319450
2-naphthalen-1-yl-N-pyridin-2-ylacetamide;hydrochloride
CID 163331171
N-(2,4-diethoxypyrimidin-5-yl)-2-(1H-indol-3-yl)acetamide
CID 122304294
N-(2,3-dimethylphenyl)-2-naphthalen-1-ylacetamide
CID 1228165
N-(2,4-dimethoxypyrimidin-5-yl)-2-methylimidazo[1,2-a]pyridine-3-carboxamide
CID 122304066
N-(2-bromophenyl)-2-naphthalen-1-ylacetamide
CID 835456
4-tert-butyl-N-(2,4-dimethoxypyrimidin-5-yl)benzamide
CID 122303930
N-(2,4-dimethoxypyrimidin-5-yl)-7-methoxy-1-benzofuran-2-carboxamide
CID 122304022

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide?
The IUPAC name of N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide (CID 122304049) is N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide.
What is the SMILES notation for N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide?
The canonical SMILES for N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide is COc1ncc(NC(=O)Cc2cccc3ccccc23)c(OC)n1.
What is the InChIKey of N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide?
The InChIKey is VYUQBDOMNZLOOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O3/c1-23-17-15(11-19-18(21-17)24-2)20-16(22)10-13-8-5-7-12-6-3-4-9-14(12)13/h3-9,11H,10H2,1-2H3,(H,20,22).
What are the key properties of N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide?
N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide has a molecular weight of 323.35 g/mol, XLogP of 2.83, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxypyrimidin-5-yl)-2-naphthalen-1-ylacetamide is sourced from PubChem (CID 122304049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).