2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide

C12H20N6O2 — CID 80934481

IUPAC2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNc1cc(N(CC(N)=O)CC(N)=O)nc(CC)n1
InChIInChI=1S/C12H20N6O2/c1-3-10-16-11(15-4-2)5-12(17-10)18(6-8(13)19)7-9(14)20/h5H,3-4,6-7H2,1-2H3,(H2,13,19)(H2,14,20)(H,15,16,17)
InChIKeyZPHKCKGKVHDRIS-UHFFFAOYSA-N
MW280.33 g/mol
LogP-0.75
Rot. Bonds8

About 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide

2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80934481) has the molecular formula C12H20N6O2 and a molecular weight of 280.33 g/mol. Its IUPAC name is 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound Name2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80934481
Molecular FormulaC12H20N6O2
Molecular Weight280.33 g/mol
Exact Mass280.16
IUPAC Name2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNc1cc(N(CC(N)=O)CC(N)=O)nc(CC)n1
InChIInChI=1S/C12H20N6O2/c1-3-10-16-11(15-4-2)5-12(17-10)18(6-8(13)19)7-9(14)20/h5H,3-4,6-7H2,1-2H3,(H2,13,19)(H2,14,20)(H,15,16,17)
InChIKeyZPHKCKGKVHDRIS-UHFFFAOYSA-N
XLogP-0.75
TPSA127.23 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.33
LogP ≤ 5-0.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

2-[[2-(ethoxymethyl)-6-(ethylamino)pyrimidin-4-yl]-ethylamino]acetamide
CID 103104342
2-[ethyl-[2-propyl-6-(propylamino)pyrimidin-4-yl]amino]acetamide
CID 103104455
3-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanamide
CID 80933202
1-[ethyl-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]-2-methylpropan-2-ol
CID 80942101
4-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]butanamide
CID 80933799
N-ethyl-2-[ethyl-[6-(ethylamino)-2-propylpyrimidin-4-yl]amino]acetamide
CID 80941432
3-[ethyl-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]propanenitrile
CID 80934943
2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]-N-propylacetamide
CID 80933651
2-[butyl-(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]acetamide
CID 80947162
N-cyclopropyl-2-[[2-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80934592
4-N-(3,5-dimethylphenyl)-6-N,2-diethyl-4-N-methylpyrimidine-4,6-diamine
CID 80940477
2-ethyl-6-(ethylamino)pyrimidine-4-carboxylic acid
CID 82169792

Frequently Asked Questions

What is the IUPAC name of 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide (CID 80934481) is 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide is CCNc1cc(N(CC(N)=O)CC(N)=O)nc(CC)n1.
What is the InChIKey of 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is ZPHKCKGKVHDRIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N6O2/c1-3-10-16-11(15-4-2)5-12(17-10)18(6-8(13)19)7-9(14)20/h5H,3-4,6-7H2,1-2H3,(H2,13,19)(H2,14,20)(H,15,16,17).
What are the key properties of 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide?
2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 280.33 g/mol, XLogP of -0.75, 8 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-amino-2-oxoethyl)-[2-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80934481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).