2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide

C12H22N6O — CID 113405792

IUPAC2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide
SMILESCc1nc(NN)c(C)c(NCC(=O)NCC(C)C)n1
InChIInChI=1S/C12H22N6O/c1-7(2)5-14-10(19)6-15-11-8(3)12(18-13)17-9(4)16-11/h7H,5-6,13H2,1-4H3,(H,14,19)(H2,15,16,17,18)
InChIKeyRWOGEUCCUCMSLF-UHFFFAOYSA-N
MW266.35 g/mol
LogP0.56
Rot. Bonds6

About 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide

2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide (PubChem CID 113405792) has the molecular formula C12H22N6O and a molecular weight of 266.35 g/mol. Its IUPAC name is 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound Name2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide
PubChem CID113405792
Molecular FormulaC12H22N6O
Molecular Weight266.35 g/mol
Exact Mass266.19
IUPAC Name2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide
SMILESCc1nc(NN)c(C)c(NCC(=O)NCC(C)C)n1
InChIInChI=1S/C12H22N6O/c1-7(2)5-14-10(19)6-15-11-8(3)12(18-13)17-9(4)16-11/h7H,5-6,13H2,1-4H3,(H,14,19)(H2,15,16,17,18)
InChIKeyRWOGEUCCUCMSLF-UHFFFAOYSA-N
XLogP0.56
TPSA104.96 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.35
LogP ≤ 50.56
H-Bond Donors ≤ 54
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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Frequently Asked Questions

What is the IUPAC name of 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide?
The IUPAC name of 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide (CID 113405792) is 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide.
What is the SMILES notation for 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide?
The canonical SMILES for 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide is Cc1nc(NN)c(C)c(NCC(=O)NCC(C)C)n1.
What is the InChIKey of 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide?
The InChIKey is RWOGEUCCUCMSLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O/c1-7(2)5-14-10(19)6-15-11-8(3)12(18-13)17-9(4)16-11/h7H,5-6,13H2,1-4H3,(H,14,19)(H2,15,16,17,18).
What are the key properties of 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide?
2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide has a molecular weight of 266.35 g/mol, XLogP of 0.56, 6 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(6-hydrazinyl-2,5-dimethylpyrimidin-4-yl)amino]-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 113405792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).