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

C16H19FN4O — CID 122356290

IUPACN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide
SMILESCc1nc(N(C)C)nc(C)c1NC(=O)Cc1ccccc1F
InChIInChI=1S/C16H19FN4O/c1-10-15(11(2)19-16(18-10)21(3)4)20-14(22)9-12-7-5-6-8-13(12)17/h5-8H,9H2,1-4H3,(H,20,22)
InChIKeyFQPXJAMWKGPJFO-UHFFFAOYSA-N
MW302.35 g/mol
LogP2.48
Rot. Bonds4

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

N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide (PubChem CID 122356290) has the molecular formula C16H19FN4O and a molecular weight of 302.35 g/mol. Its IUPAC name is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide
PubChem CID122356290
Molecular FormulaC16H19FN4O
Molecular Weight302.35 g/mol
Exact Mass302.15
IUPAC NameN-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide
SMILESCc1nc(N(C)C)nc(C)c1NC(=O)Cc1ccccc1F
InChIInChI=1S/C16H19FN4O/c1-10-15(11(2)19-16(18-10)21(3)4)20-14(22)9-12-7-5-6-8-13(12)17/h5-8H,9H2,1-4H3,(H,20,22)
InChIKeyFQPXJAMWKGPJFO-UHFFFAOYSA-N
XLogP2.48
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.35
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2,6-difluorobenzamide
CID 91968502
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenyl)acetamide
CID 75400804
2-(2-fluorophenyl)-N-(6-methyl-3-pyridinyl)acetamide
CID 112532440
2-(2,4-difluorophenyl)-N-[2-(2-fluorophenoxy)-4,6-dimethylpyrimidin-5-yl]acetamide
CID 122303430
2-(2-fluorophenyl)-N-(2-methylimidazo[1,2-a]pyridin-6-yl)acetamide
CID 110734846
N-[2-(2-fluorophenoxy)-4,6-dimethylpyrimidin-5-yl]-2-phenylacetamide
CID 122303244
N-[4-(dimethylamino)-2-methoxypyrimidin-5-yl]-2-(2-fluorophenyl)acetamide
CID 122319450
N-[6-(2,6-dimethylanilino)pyridazin-3-yl]-2-(2-fluorophenyl)acetamide
CID 113046519
2-(2,3-difluorophenyl)-N-[4-(dimethylamino)-2,6-dimethylphenyl]acetamide
CID 167794826
N-[2-[[4-(dimethylamino)-6-methylpyrimidin-2-yl]amino]ethyl]-2-(2-fluorophenyl)acetamide
CID 122295436
2-(2-fluorophenyl)-N-quinolin-2-ylacetamide
CID 51193537
5-[[2-(2-fluorophenyl)acetyl]amino]-3-methyl-1,2-thiazole-4-carboxylic acid
CID 60871549

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide?
The IUPAC name of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide (CID 122356290) is N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide.
What is the SMILES notation for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide?
The canonical SMILES for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide is Cc1nc(N(C)C)nc(C)c1NC(=O)Cc1ccccc1F.
What is the InChIKey of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide?
The InChIKey is FQPXJAMWKGPJFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19FN4O/c1-10-15(11(2)19-16(18-10)21(3)4)20-14(22)9-12-7-5-6-8-13(12)17/h5-8H,9H2,1-4H3,(H,20,22).
What are the key properties of N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide?
N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide has a molecular weight of 302.35 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-4,6-dimethylpyrimidin-5-yl]-2-(2-fluorophenyl)acetamide is sourced from PubChem (CID 122356290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).