N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide

C13H23N5O — CID 80804836

IUPACN-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNC(=O)CN(CC)c1ncnc(NC)c1CC
InChIInChI=1S/C13H23N5O/c1-5-10-12(14-4)16-9-17-13(10)18(7-3)8-11(19)15-6-2/h9H,5-8H2,1-4H3,(H,15,19)(H,14,16,17)
InChIKeyGTNDAUPFFUJXLE-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.04
Rot. Bonds7

About N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide

N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide (PubChem CID 80804836) has the molecular formula C13H23N5O and a molecular weight of 265.36 g/mol. Its IUPAC name is N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide.

Molecular Properties

Compound NameN-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
PubChem CID80804836
Molecular FormulaC13H23N5O
Molecular Weight265.36 g/mol
Exact Mass265.19
IUPAC NameN-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide
SMILESCCNC(=O)CN(CC)c1ncnc(NC)c1CC
InChIInChI=1S/C13H23N5O/c1-5-10-12(14-4)16-9-17-13(10)18(7-3)8-11(19)15-6-2/h9H,5-8H2,1-4H3,(H,15,19)(H,14,16,17)
InChIKeyGTNDAUPFFUJXLE-UHFFFAOYSA-N
XLogP1.04
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-ethyl-2-[[5-ethyl-6-(methylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80804475
2-[(6-amino-5-ethylpyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 80805333
2-[[5-ethyl-6-(methylamino)pyrimidin-4-yl]-propylamino]-N-methylacetamide
CID 80806342
N-ethyl-2-[ethyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]acetamide
CID 80905620
4-N-(2-ethoxyethyl)-4-N,5-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80834415
4-N-cyclopropyl-4-N,5-diethyl-6-N-methylpyrimidine-4,6-diamine
CID 80774359
2-[[5-bromo-6-(ethylamino)pyrimidin-4-yl]-methylamino]-N-ethylacetamide
CID 114072094
N,N-diethyl-2-[[5-ethyl-6-(ethylamino)pyrimidin-4-yl]-methylamino]acetamide
CID 80779733
2-[[4-(aminomethyl)-5,6-diethylpyridazin-3-yl]-ethylamino]-N-ethylacetamide
CID 80508158
6-N,5-diethyl-4-N,4-N-dipropylpyrimidine-4,6-diamine
CID 80764406
2-[(2,5-dichloropyrimidin-4-yl)-ethylamino]-N-ethylacetamide
CID 79633316
4-N,6-N,5-triethyl-4-N-(2-methoxyethyl)pyrimidine-4,6-diamine
CID 80808569

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The IUPAC name of N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide (CID 80804836) is N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide.
What is the SMILES notation for N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The canonical SMILES for N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide is CCNC(=O)CN(CC)c1ncnc(NC)c1CC.
What is the InChIKey of N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide?
The InChIKey is GTNDAUPFFUJXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N5O/c1-5-10-12(14-4)16-9-17-13(10)18(7-3)8-11(19)15-6-2/h9H,5-8H2,1-4H3,(H,15,19)(H,14,16,17).
What are the key properties of N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide?
N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.04, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[ethyl-[5-ethyl-6-(methylamino)pyrimidin-4-yl]amino]acetamide is sourced from PubChem (CID 80804836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).