1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine

C13H26N6 — CID 81006767

IUPAC1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
SMILESCCCc1nc(NN)c(C)c(NCC(C)N(C)C)n1
InChIInChI=1S/C13H26N6/c1-6-7-11-16-12(10(3)13(17-11)18-14)15-8-9(2)19(4)5/h9H,6-8,14H2,1-5H3,(H2,15,16,17,18)
InChIKeyBBKNBPQRAOZTQB-UHFFFAOYSA-N
MW266.39 g/mol
LogP1.39
Rot. Bonds7

About 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine

1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine (PubChem CID 81006767) has the molecular formula C13H26N6 and a molecular weight of 266.39 g/mol. Its IUPAC name is 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine.

Molecular Properties

Compound Name1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
PubChem CID81006767
Molecular FormulaC13H26N6
Molecular Weight266.39 g/mol
Exact Mass266.22
IUPAC Name1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine
SMILESCCCc1nc(NN)c(C)c(NCC(C)N(C)C)n1
InChIInChI=1S/C13H26N6/c1-6-7-11-16-12(10(3)13(17-11)18-14)15-8-9(2)19(4)5/h9H,6-8,14H2,1-5H3,(H2,15,16,17,18)
InChIKeyBBKNBPQRAOZTQB-UHFFFAOYSA-N
XLogP1.39
TPSA79.10 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.39
LogP ≤ 51.39
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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Frequently Asked Questions

What is the IUPAC name of 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The IUPAC name of 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine (CID 81006767) is 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine.
What is the SMILES notation for 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The canonical SMILES for 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine is CCCc1nc(NN)c(C)c(NCC(C)N(C)C)n1.
What is the InChIKey of 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
The InChIKey is BBKNBPQRAOZTQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N6/c1-6-7-11-16-12(10(3)13(17-11)18-14)15-8-9(2)19(4)5/h9H,6-8,14H2,1-5H3,(H2,15,16,17,18).
What are the key properties of 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine?
1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine has a molecular weight of 266.39 g/mol, XLogP of 1.39, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-(6-hydrazinyl-5-methyl-2-propylpyrimidin-4-yl)-2-N,2-N-dimethylpropane-1,2-diamine is sourced from PubChem (CID 81006767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).