2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide

C13H23N5O — CID 103104381

IUPAC2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
SMILESCCN(CC(N)=O)c1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C13H23N5O/c1-6-18(7-10(14)19)13-9(4)12(15-5)16-11(17-13)8(2)3/h8H,6-7H2,1-5H3,(H2,14,19)(H,15,16,17)
InChIKeyBANGHKHCGNOOMO-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.26
Rot. Bonds6

About 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide

2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide (PubChem CID 103104381) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound Name2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
PubChem CID103104381
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC Name2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
SMILESCCN(CC(N)=O)c1nc(C(C)C)nc(NC)c1C
InChIInChI=1S/C13H23N5O/c1-6-18(7-10(14)19)13-9(4)12(15-5)16-11(17-13)8(2)3/h8H,6-7H2,1-5H3,(H2,14,19)(H,15,16,17)
InChIKeyBANGHKHCGNOOMO-UHFFFAOYSA-N
XLogP1.26
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-[3-(dimethylamino)propyl]-4-N-ethyl-6-N,5-dimethyl-2-propan-2-ylpyrimidine-4,6-diamine
CID 102998896
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-(2-methylpropyl)amino]acetamide
CID 80820561
2-[[2,5-dimethyl-6-(methylamino)pyrimidin-4-yl]-ethylamino]-N-propan-2-ylacetamide
CID 80805162
2-[[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide
CID 80981186
2-[methyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]-N-propan-2-ylacetamide
CID 80993955
2-[butyl-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
CID 80982412
1-[methyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]propan-2-ol
CID 80982737
2-[ethyl-[2-ethyl-5-methyl-6-(methylamino)pyrimidin-4-yl]amino]-N-methylacetamide
CID 80987036
2-[methyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]ethanol
CID 80980902
N-ethyl-6-hydrazinyl-5-methyl-N-(2-methylbutyl)-2-propan-2-ylpyrimidin-4-amine
CID 81006834
N-butyl-N-ethyl-6-hydrazinyl-5-methyl-2-propan-2-ylpyrimidin-4-amine
CID 81005990
2-[[3,5-dichloro-6-(methylamino)-2-pyridinyl]-ethylamino]acetamide
CID 103104349

Frequently Asked Questions

What is the IUPAC name of 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The IUPAC name of 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide (CID 103104381) is 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The canonical SMILES for 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide is CCN(CC(N)=O)c1nc(C(C)C)nc(NC)c1C.
What is the InChIKey of 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
The InChIKey is BANGHKHCGNOOMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-6-18(7-10(14)19)13-9(4)12(15-5)16-11(17-13)8(2)3/h8H,6-7H2,1-5H3,(H2,14,19)(H,15,16,17).
What are the key properties of 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide?
2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.26, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[ethyl-[5-methyl-6-(methylamino)-2-propan-2-ylpyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 103104381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).