2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide

C11H20N6O — CID 80904395

IUPAC2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide
SMILESCCc1c(NN)ncnc1N(CC(N)=O)C(C)C
InChIInChI=1S/C11H20N6O/c1-4-8-10(16-13)14-6-15-11(8)17(7(2)3)5-9(12)18/h6-7H,4-5,13H2,1-3H3,(H2,12,18)(H,14,15,16)
InChIKeyYZKYEMGEOUFOEF-UHFFFAOYSA-N
MW252.32 g/mol
LogP0.02
Rot. Bonds6

About 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide

2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide (PubChem CID 80904395) has the molecular formula C11H20N6O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide.

Molecular Properties

Compound Name2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide
PubChem CID80904395
Molecular FormulaC11H20N6O
Molecular Weight252.32 g/mol
Exact Mass252.17
IUPAC Name2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide
SMILESCCc1c(NN)ncnc1N(CC(N)=O)C(C)C
InChIInChI=1S/C11H20N6O/c1-4-8-10(16-13)14-6-15-11(8)17(7(2)3)5-9(12)18/h6-7H,4-5,13H2,1-3H3,(H2,12,18)(H,14,15,16)
InChIKeyYZKYEMGEOUFOEF-UHFFFAOYSA-N
XLogP0.02
TPSA110.16 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 50.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-[ethyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]acetamide
CID 103104506
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-methylamino]-N,2-dimethylpropanamide
CID 106918799
2-[[6-(methylamino)-5-nitropyrimidin-4-yl]-propan-2-ylamino]acetamide
CID 80806061
2-[(3,5-dichloro-6-hydrazinyl-2-pyridinyl)-propan-2-ylamino]acetamide
CID 102761839
5-ethyl-6-hydrazinyl-N-methyl-N-pentan-3-ylpyrimidin-4-amine
CID 80906749
2-[butyl-(6-hydrazinyl-5-propan-2-ylpyrimidin-4-yl)amino]acetamide
CID 80902095
3-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-2-hydroxypropanamide
CID 106179504
N'-(5-ethyl-6-hydrazinylpyrimidin-4-yl)-N,N,N'-trimethylethane-1,2-diamine
CID 80909904
2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]-N-methylpropanamide
CID 80897748
2-[cyclopentyl-[5-ethyl-6-(ethylamino)pyrimidin-4-yl]amino]acetamide
CID 80786697
N'-(5-ethyl-6-hydrazinylpyrimidin-4-yl)-N,N-dimethyl-N'-(2-methylpropyl)ethane-1,2-diamine
CID 80901167
1-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)amino]propan-2-ol
CID 80906559

Frequently Asked Questions

What is the IUPAC name of 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide?
The IUPAC name of 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide (CID 80904395) is 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide.
What is the SMILES notation for 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide?
The canonical SMILES for 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide is CCc1c(NN)ncnc1N(CC(N)=O)C(C)C.
What is the InChIKey of 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide?
The InChIKey is YZKYEMGEOUFOEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6O/c1-4-8-10(16-13)14-6-15-11(8)17(7(2)3)5-9(12)18/h6-7H,4-5,13H2,1-3H3,(H2,12,18)(H,14,15,16).
What are the key properties of 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide?
2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide has a molecular weight of 252.32 g/mol, XLogP of 0.02, 6 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-ethyl-6-hydrazinylpyrimidin-4-yl)-propan-2-ylamino]acetamide is sourced from PubChem (CID 80904395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).