2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide

C10H15FN4O — CID 100690449

IUPAC2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide
SMILESCCc1ncnc(N(CC)CC(N)=O)c1F
InChIInChI=1S/C10H15FN4O/c1-3-7-9(11)10(14-6-13-7)15(4-2)5-8(12)16/h6H,3-5H2,1-2H3,(H2,12,16)
InChIKeyXZZGOTGAUFYWKG-UHFFFAOYSA-N
MW226.25 g/mol
LogP0.49
Rot. Bonds5

About 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide

2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide (PubChem CID 100690449) has the molecular formula C10H15FN4O and a molecular weight of 226.25 g/mol. Its IUPAC name is 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide.

Molecular Properties

Compound Name2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide
PubChem CID100690449
Molecular FormulaC10H15FN4O
Molecular Weight226.25 g/mol
Exact Mass226.12
IUPAC Name2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide
SMILESCCc1ncnc(N(CC)CC(N)=O)c1F
InChIInChI=1S/C10H15FN4O/c1-3-7-9(11)10(14-6-13-7)15(4-2)5-8(12)16/h6H,3-5H2,1-2H3,(H2,12,16)
InChIKeyXZZGOTGAUFYWKG-UHFFFAOYSA-N
XLogP0.49
TPSA72.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.25
LogP ≤ 50.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(6-Ethyl-5-fluoropyrimidin-4-yl)morpholine-3-carboxamide
CID 84597644
2-[4-(dimethylamino)-5,6,8,9-tetrahydropyrimido[4,5-d]azepin-7-yl]-N,N-dimethylacetamide
CID 97462145
2-{[6-(2-aminoethyl)pyrimidin-4-yl]amino}-N-(tert-butyl)acetamide
CID 56702333
4-Ethyl-5-fluoro-6-(4-isopropylpiperazin-1-yl)pyrimidine
CID 119103485
4-(6-Ethyl-5-fluoropyrimidin-4-yl)piperazin-2-one
CID 121020662
1-[1-(6-Ethyl-5-fluoropyrimidin-4-yl)azetidin-3-yl]-3-methylurea
CID 121537353
(3S)-1-(6-ethyl-5-fluoropyrimidin-4-yl)pyrrolidine-3-carboxamide
CID 164629934
6-Ethyl-5-fluoropyrimidin-4-amine
CID 108151370
6-N-[(2S)-2-fluorobutyl]-6-N-methyl-7,8-dihydropyrido[3,2-d]pyrimidine-4,6-diamine
CID 145675985
5-Fluoro-4-propan-2-ylpyrimidine-2-carboxamide
CID 155161750
1-(Azetidin-1-yl)-2-[(6-ethyl-5-fluoropyrimidin-4-yl)amino]ethanone;ethane;trifluoro(methoxy)methane
CID 178126452
(2R)-2-[[6-(3-fluorobut-3-enyl)pyrimidin-4-yl]amino]-1-pyrrolidin-1-ylpropan-1-one
CID 178126666

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide?
The IUPAC name of 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide (CID 100690449) is 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide.
What is the SMILES notation for 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide?
The canonical SMILES for 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide is CCc1ncnc(N(CC)CC(N)=O)c1F.
What is the InChIKey of 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide?
The InChIKey is XZZGOTGAUFYWKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN4O/c1-3-7-9(11)10(14-6-13-7)15(4-2)5-8(12)16/h6H,3-5H2,1-2H3,(H2,12,16).
What are the key properties of 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide?
2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide has a molecular weight of 226.25 g/mol, XLogP of 0.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-(6-ethyl-5-fluoropyrimidin-4-yl)amino]acetamide is sourced from PubChem (CID 100690449), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).