2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide

C8H11FN4O — CID 103634769

IUPAC2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide
SMILESCNC(=O)CNc1ncnc(C)c1F
InChIInChI=1S/C8H11FN4O/c1-5-7(9)8(13-4-12-5)11-3-6(14)10-2/h4H,3H2,1-2H3,(H,10,14)(H,11,12,13)
InChIKeySNJRUYQTIZIGRA-UHFFFAOYSA-N
MW198.20 g/mol
LogP0.08
Rot. Bonds3

About 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide

2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide (PubChem CID 103634769) has the molecular formula C8H11FN4O and a molecular weight of 198.20 g/mol. Its IUPAC name is 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide.

Molecular Properties

Compound Name2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide
PubChem CID103634769
Molecular FormulaC8H11FN4O
Molecular Weight198.20 g/mol
Exact Mass198.09
IUPAC Name2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide
SMILESCNC(=O)CNc1ncnc(C)c1F
InChIInChI=1S/C8H11FN4O/c1-5-7(9)8(13-4-12-5)11-3-6(14)10-2/h4H,3H2,1-2H3,(H,10,14)(H,11,12,13)
InChIKeySNJRUYQTIZIGRA-UHFFFAOYSA-N
XLogP0.08
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.20
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-butyl-5-fluoro-6-methylpyrimidine-2,4-diamine
CID 135271009
4-methyl-5H-pteridin-6-one
CID 595562
Pteridine, 5-acetyl-5,6,7,8-tetrahydro-4-methyl-
CID 23422332
Pyrimidine, 4-amino-6-methyl-5-methylformamido-
CID 145618706
Pteridine, 8-ethyl-2-ethylamino-7,8-dihydro-4-methyl-7-oxo-
CID 171384108
N-methyl-2-[methyl-[4-(trifluoromethyl)pyrimidin-2-yl]amino]acetamide
CID 31536708
2-[(4,5-Dimethylpyrimidin-2-YL)amino]-N-ethylacetamide
CID 86802910
2-[Ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide
CID 100690449
4-(6-Ethyl-5-fluoropyrimidin-4-yl)piperazin-2-one
CID 121020662
(3S)-3-[(5-fluoro-2,6-dimethylpyrimidin-4-yl)amino]piperidin-2-one
CID 128563070
4-N-(2-aminoethyl)-5-fluoro-4-N,6-dimethylpyrimidine-2,4-diamine
CID 59777243
2-N-(2-aminoethyl)-5-fluoro-4-N,6-dimethylpyrimidine-2,4-diamine
CID 67095980

Frequently Asked Questions

What is the IUPAC name of 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide?
The IUPAC name of 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide (CID 103634769) is 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide.
What is the SMILES notation for 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide?
The canonical SMILES for 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide is CNC(=O)CNc1ncnc(C)c1F.
What is the InChIKey of 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide?
The InChIKey is SNJRUYQTIZIGRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN4O/c1-5-7(9)8(13-4-12-5)11-3-6(14)10-2/h4H,3H2,1-2H3,(H,10,14)(H,11,12,13).
What are the key properties of 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide?
2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide has a molecular weight of 198.20 g/mol, XLogP of 0.08, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-fluoro-6-methylpyrimidin-4-yl)amino]-N-methylacetamide is sourced from PubChem (CID 103634769), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).