2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide

C13H23N5O — CID 80982855

IUPAC2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCNc1nc(CC)nc(NC(C)(C)C(N)=O)c1C
InChIInChI=1S/C13H23N5O/c1-6-9-16-10(15-7-2)8(3)11(17-9)18-13(4,5)12(14)19/h6-7H2,1-5H3,(H2,14,19)(H2,15,16,17,18)
InChIKeyIFZOTDFGVXBYDW-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.46
Rot. Bonds6

About 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide

2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide (PubChem CID 80982855) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide.

Molecular Properties

Compound Name2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
PubChem CID80982855
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
SMILESCCNc1nc(CC)nc(NC(C)(C)C(N)=O)c1C
InChIInChI=1S/C13H23N5O/c1-6-9-16-10(15-7-2)8(3)11(17-9)18-13(4,5)12(14)19/h6-7H2,1-5H3,(H2,14,19)(H2,15,16,17,18)
InChIKeyIFZOTDFGVXBYDW-UHFFFAOYSA-N
XLogP1.46
TPSA92.93 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.46
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-[[2-cyclopropyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide
CID 80982786
6-N,2-diethyl-4-N-(3-ethylpentan-3-yl)-5-methylpyrimidine-4,6-diamine
CID 80991789
6-N,2-diethyl-5-methyl-4-N-(2-methylbutan-2-yl)pyrimidine-4,6-diamine
CID 80976798
ethyl 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]acetate
CID 80993875
3-[[6-(ethylamino)-5-methyl-2-propylpyrimidin-4-yl]amino]-2,2-dimethylpropanamide
CID 106280580
6-N,2-diethyl-5-methyl-4-N-propylpyrimidine-4,6-diamine
CID 80980725
3-[[6-(ethylamino)-2,5-dimethylpyrimidin-4-yl]amino]-3-methylbutanamide
CID 106098849
3-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]propane-1-sulfonamide
CID 80982715
3-[(6-amino-2-ethyl-5-methylpyrimidin-4-yl)amino]-3-methylbutanamide
CID 106098699
1-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-4,4-dimethylpentan-2-ol
CID 107159606
6-chloro-N,2-diethyl-5-methylpyrimidin-4-amine
CID 79557526
2-[(6-amino-2-tert-butyl-5-methylpyrimidin-4-yl)amino]-2-methylpropanamide
CID 80982285

Frequently Asked Questions

What is the IUPAC name of 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The IUPAC name of 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide (CID 80982855) is 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide.
What is the SMILES notation for 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The canonical SMILES for 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide is CCNc1nc(CC)nc(NC(C)(C)C(N)=O)c1C.
What is the InChIKey of 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
The InChIKey is IFZOTDFGVXBYDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-6-9-16-10(15-7-2)8(3)11(17-9)18-13(4,5)12(14)19/h6-7H2,1-5H3,(H2,14,19)(H2,15,16,17,18).
What are the key properties of 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide?
2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide has a molecular weight of 265.36 g/mol, XLogP of 1.46, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[2-ethyl-6-(ethylamino)-5-methylpyrimidin-4-yl]amino]-2-methylpropanamide is sourced from PubChem (CID 80982855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).