N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide

C15H17FN4O2 — CID 122354279

IUPACN-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide
SMILESCN(C)c1nccc(CNC(=O)COc2ccccc2F)n1
InChIInChI=1S/C15H17FN4O2/c1-20(2)15-17-8-7-11(19-15)9-18-14(21)10-22-13-6-4-3-5-12(13)16/h3-8H,9-10H2,1-2H3,(H,18,21)
InChIKeySYGLSZIXUFGCTK-UHFFFAOYSA-N
MW304.32 g/mol
LogP1.38
Rot. Bonds6

About N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide

N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide (PubChem CID 122354279) has the molecular formula C15H17FN4O2 and a molecular weight of 304.32 g/mol. Its IUPAC name is N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide
PubChem CID122354279
Molecular FormulaC15H17FN4O2
Molecular Weight304.32 g/mol
Exact Mass304.13
IUPAC NameN-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide
SMILESCN(C)c1nccc(CNC(=O)COc2ccccc2F)n1
InChIInChI=1S/C15H17FN4O2/c1-20(2)15-17-8-7-11(19-15)9-18-14(21)10-22-13-6-4-3-5-12(13)16/h3-8H,9-10H2,1-2H3,(H,18,21)
InChIKeySYGLSZIXUFGCTK-UHFFFAOYSA-N
XLogP1.38
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.32
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(4-fluorophenoxy)acetamide
CID 122354280
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenyl)acetamide
CID 75400804
2-(2-fluorophenoxy)-N-[(2-methyl-1,3-oxazol-4-yl)methyl]acetamide
CID 110714661
2-(2-fluorophenoxy)-N-[(2-propan-2-yl-1,3-thiazol-4-yl)methyl]acetamide
CID 110728111
2-(2-fluorophenoxy)-N-[[2-[(3R)-oxan-3-yl]pyrimidin-4-yl]methyl]acetamide
CID 124987265
N-[2,4-bis(dimethylamino)pyrimidin-5-yl]-2-(2-fluorophenoxy)acetamide
CID 122319662
2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979329
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]isoquinoline-1-carboxamide
CID 122354329
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]acetamide
CID 122354210
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
2-(2-fluorophenoxy)-N-[(6-phenylpyrimidin-4-yl)methyl]acetamide
CID 122261805
N-(2,6-difluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 892688

Frequently Asked Questions

What is the IUPAC name of N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide?
The IUPAC name of N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide (CID 122354279) is N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide.
What is the SMILES notation for N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide?
The canonical SMILES for N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide is CN(C)c1nccc(CNC(=O)COc2ccccc2F)n1.
What is the InChIKey of N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide?
The InChIKey is SYGLSZIXUFGCTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17FN4O2/c1-20(2)15-17-8-7-11(19-15)9-18-14(21)10-22-13-6-4-3-5-12(13)16/h3-8H,9-10H2,1-2H3,(H,18,21).
What are the key properties of N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide?
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide has a molecular weight of 304.32 g/mol, XLogP of 1.38, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide is sourced from PubChem (CID 122354279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).